[ CAS No. 2489-13-6 ] {[proInfo.proName]}

Name: 2489-13-6|(S)-2-(2-Aminoacetamido)-3-(1H-imidazol-4-yl)propanoic acid|98+%
Brand: Ambeed
SKU: A853280
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Quality Control of [ 2489-13-6 ]

COA NMR CNMR HPLC LC-MS

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SDS Specification

Alternatived Products of [ 2489-13-6 ]

Product Details of [ 2489-13-6 ]

CAS No. :	2489-13-6	MDL No. :	MFCD00167467
Formula :	C₈H₁₂N₄O₃	Boiling Point :	-
Linear Structure Formula :	-	InChI Key :	YIWFXZNIBQBFHR-LURJTMIESA-N
M.W :	212.21	Pubchem ID :	7023107
Synonyms :

Calculated chemistry of [ 2489-13-6 ]

Physicochemical Properties

Num. heavy atoms :	15
Num. arom. heavy atoms :	5
Fraction Csp3 :	0.38
Num. rotatable bonds :	6
Num. H-bond acceptors :	5.0
Num. H-bond donors :	4.0
Molar Refractivity :	50.26
TPSA :	121.1 Å²

Pharmacokinetics

GI absorption :	High
BBB permeant :	No
P-gp substrate :	No
CYP1A2 inhibitor :	No
CYP2C19 inhibitor :	No
CYP2C9 inhibitor :	No
CYP2D6 inhibitor :	No
CYP3A4 inhibitor :	No
Log Kp (skin permeation) :	-10.6 cm/s

Lipophilicity

Log Po/w (iLOGP) :	-0.47
Log Po/w (XLOGP3) :	-4.24
Log Po/w (WLOGP) :	-1.52
Log Po/w (MLOGP) :	-2.13
Log Po/w (SILICOS-IT) :	-0.56
Consensus Log Po/w :	-1.79

Druglikeness

Lipinski :	0.0
Ghose :	None
Veber :	0.0
Egan :	0.0
Muegge :	1.0
Bioavailability Score :	0.55

Water Solubility

Log S (ESOL) :	1.66
Solubility :	9810.0 mg/ml ; 46.2 mol/l
Class :	Highly soluble
Log S (Ali) :	2.31
Solubility :	42900.0 mg/ml ; 202.0 mol/l
Class :	Highly soluble
Log S (SILICOS-IT) :	-1.12
Solubility :	16.2 mg/ml ; 0.0766 mol/l
Class :	Soluble

Medicinal Chemistry

PAINS :	0.0 alert
Brenk :	0.0 alert
Leadlikeness :	1.0
Synthetic accessibility :	2.48

Safety of [ 2489-13-6 ]

Signal Word:	Warning	Class:
Precautionary Statements:	P261-P280-P301+P312-P302+P352-P305+P351+P338	UN#:
Hazard Statements:	H302-H315-H319-H335	Packing Group:
GHS Pictogram:

Application In Synthesis of [ 2489-13-6 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

Downstream synthetic route of [ 2489-13-6 ]

[ 2489-13-6 ] Synthesis Path-Downstream 1~40

1
[ 503622-97-7 ]
[ 2489-13-6 ]

Yield	Reaction Conditions	Operation in experiment
	With ethanol; water; hydrazine hydrate

Reference： [1]Turner [Journal of the American Chemical Society, 1953, vol. 75, p. 2388]

2
[ 31321-63-8 ]
[ 2489-13-6 ]

Yield	Reaction Conditions	Operation in experiment
81%	With hydrogen In methanol; acetic acid Ambient temperature;
	With palladium on activated charcoal Hydrogenation;

Reference： [1]Foerster, Martin; Vahrenkamp, Heinrich [Chemische Berichte, 1995, vol. 128, # 6, p. 541 - 550]
[2]Akabori et al. [Bulletin of the Chemical Society of Japan, 1958, vol. 31, p. 784]

3
[ 50622-95-2 ]
[ 1499-46-3 ]
[ 2489-13-6 ]

Yield	Reaction Conditions	Operation in experiment
	ueber mehrere Stufen;

Reference： [1]Weitzel et al. [Hoppe-Seyler's Zeitschrift fur Physiologische Chemie, 1957, vol. 307, p. 23,31]

4
[ 2489-13-6 ]
[ 53-84-9 ]
glycylhistidine adenine dinucleotide [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	at 37℃; for 20h; NADase;

Reference： [1]Tono-oka, Shuichi; Azuma, Ichiro [Acta Chemica Scandinavica, 1994, vol. 48, # 9, p. 780 - 782]

Yield	Reaction Conditions	Operation in experiment
	Protonierungskonst.;
	Rk. mit D-γ-Glutamyl-p-nitroanilid in Ggw. v. Glutamyl-Transpeptidase: kineti sche Parameter: V(t)/K(t);
	Rk. mit β-Co(trien)OH(H2O)²⁺ (I): Produktanalyse (Tab.I); trien: H2N<CH2CH2NH>2CH2CH2NH2;

	With sodium vanadate; dihydrogen peroxide In water Ambient temperature; pH 6.5;
	With ethylenediaminetetraacetic acid; 2-Deoxy-D-ribose; hydroxyl In phosphate buffer at 37℃;
	With 2,2,3,3-Tetradeutero-3-trimethylsilylpropionsaeure; 61H₂O14Na⁽¹⁺⁾4Zr⁽⁴⁺⁾2O^(2-)2HO^(1-)*2(P₂W₁₆O₅₉)^(12-) In water-d2 at 60℃;
	With H₆O₈₂P₂W₂₂Zr₂^(8-)8C₄H₁₁N7H₂O*8H⁽¹⁺⁾; 3-(trimethylsilyl)propionic-2,2,3,3-d<SUB>4 </SUB>acid sodium salt In water-d2 at 60℃;

Yield	Reaction Conditions	Operation in experiment
	Hydrierung von Z-Gly-His-OCH2Ph;
	Z-Gly-His-OH;

Yield	Reaction Conditions	Operation in experiment
	With hydrogenchloride; water; palladium Hydrogenation;

Yield	Reaction Conditions	Operation in experiment
	With ammonia; water

10
[ 2489-13-6 ]
[ 4083-64-1 ]
C₁₆H₁₉N₅O₆S₁ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	In acetone at 4℃; for 4h;

Reference： [1]Supuran, Claudiu T.; Scozzafava, Andrea; Briganti, Fabrizio; Clare, Brian W. [Journal of Medicinal Chemistry, 2000, vol. 43, # 9, p. 1793 - 1806]

11
[ 2489-13-6 ]
[ 5769-15-3 ]
4-chlorophenylsulfonylureido-glycyl-L-histidine [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	In acetone at 4℃; for 2h;

Reference： [1]Scozzafava, Andrea; Supuran, Claudiu T. [European Journal of Pharmaceutical Sciences, 2000, vol. 10, # 1, p. 29 - 41]

12
[ 2489-13-6 ]
4-[β-(4-chlorophenylsulfonylureido-glycyl-L-histidylamido)-ethyl]-1H-imidazole [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1: acetone / 2 h / 4 °C 2: N,N'-diisopropylcarbodiimide; 1-hydroxybenzotriazole / acetonitrile / 4 °C 3: aq. HCl / dioxane / 8 h / 40 °C

Reference： [1]Scozzafava, Andrea; Supuran, Claudiu T. [European Journal of Pharmaceutical Sciences, 2000, vol. 10, # 1, p. 29 - 41]

13
[ 2489-13-6 ]
C₃₉H₃₇ClN₈O₅S₂ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: acetone / 2 h / 4 °C 2: N,N'-diisopropylcarbodiimide; 1-hydroxybenzotriazole / acetonitrile / 4 °C

Reference： [1]Scozzafava, Andrea; Supuran, Claudiu T. [European Journal of Pharmaceutical Sciences, 2000, vol. 10, # 1, p. 29 - 41]

14
[ 2489-13-6 ]
C₂₃H₂₄N₈O₇S₂ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: acetone / 4 h / 4 °C 2: EDCI*HCl; Et₃N / acetonitrile / 16 h / 4 °C

Reference： [1]Supuran, Claudiu T.; Scozzafava, Andrea; Briganti, Fabrizio; Clare, Brian W. [Journal of Medicinal Chemistry, 2000, vol. 43, # 9, p. 1793 - 1806]

15
[ 2489-13-6 ]
C₂₃H₂₇N₉O₇S₂ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 4 steps 1: acetone / 4 h / 4 °C 2: EDCI*HCl; Et₃N / acetonitrile / 16 h / 4 °C 3: HCl(g) / dioxane / 96 h / 4 °C 4: NH₃ / methanol; ethanol / 4 h / 60 °C

Reference： [1]Supuran, Claudiu T.; Scozzafava, Andrea; Briganti, Fabrizio; Clare, Brian W. [Journal of Medicinal Chemistry, 2000, vol. 43, # 9, p. 1793 - 1806]

16
[ 2489-13-6 ]
[ 276245-71-7 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 3 steps 1: acetone / 4 h / 4 °C 2: EDCI*HCl; Et₃N / acetonitrile / 16 h / 4 °C 3: HCl(g) / dioxane / 96 h / 4 °C

Reference： [1]Supuran, Claudiu T.; Scozzafava, Andrea; Briganti, Fabrizio; Clare, Brian W. [Journal of Medicinal Chemistry, 2000, vol. 43, # 9, p. 1793 - 1806]

17
[ 71-00-1 ]
[ 2489-13-6 ]

Yield	Reaction Conditions	Operation in experiment
	Multi-step reaction with 2 steps 1: triethylamine 2: water; ethanol; N₂H₄+H₂O

Reference： [1]Turner [Journal of the American Chemical Society, 1953, vol. 75, p. 2388]

18
cobalt(III) hydroxide [ No CAS ]
[ 2489-13-6 ]
[ 71302-43-7 ]

Yield	Reaction Conditions	Operation in experiment
	In water

Reference： [1]Harris, Wesley R.; McLendon, George L.; Martell, Arthur E.; Bess, Robert C.; Mason, Michael [Inorganic Chemistry, 1980, vol. 19, # 1, p. 21 - 26]

19
[ 117228-93-0 ]
[ 2489-13-6 ]
Pt(⁽¹⁵⁾NH₃)2(H₂O)(O₂CCH(NHCOCH₂NH₃)CH₂C₃H₄N₂)⁽³⁺⁾ [ No CAS ]
Pt(⁽¹⁵⁾NH₃)2(O₂CCH(NHCOCH₂NH₃)CH₂C₃H₄N₂)2⁽⁴⁺⁾ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	With water In water dissoln. of nitratocomplex (slight heating, stirring), filtration, addn.of < 1 equiv. ligand, standing overnight; not isolated, reaction followed by NMR spectroscopy;

Reference： [1]Appleton, Trevor G.; Ross, Fraser B. [Inorganica Chimica Acta, 1996, vol. 252, # 1-2, p. 79 - 89]

20
[ 15020-99-2 ]
[ 2489-13-6 ]
[PdCl(NH₂CH₂CONCH(CH₂C₃H₃N₂)COOH)]*0.5H₂O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
70%	With aq. HCl In water stirring for dissoln. (darkness, room temp.), addn. of aq. HCl to pH of ca. 2, stirring (room temp., overnight); evapn. at room temp., removal of the Pd educt complex, refrigerator (several d), filtration, washing (EtOH), drying in air; elem. anal.;

Reference： [1]Milinkovic, Snezana U.; Parac, Tatjana N.; Djuran, Milos I.; Kostic, Nenad M. [Journal of the Chemical Society, Dalton Transactions, 1997, # 16, p. 2771 - 2776]

21
[Yb(⁽²⁾H₂O)2((R,R,R)-1,4,7-tris[1-(1-phenyl)ethylcarbamoylmethyl]-1,4,7,10-tetraazacyclododecane)](CF₃SO₃)3 [ No CAS ]
[ 2489-13-6 ]
[Yb(Gly-(S)-His)((R,R,R)-1,4,7-tris[1-(1-phenyl)ethylcarbamoylmethyl]-1,4,7,10-tetraazacyclododecane)]⁽²⁺⁾ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	In water-d2 in the presence of an excess of Gly-(S)-His (20 equiv.) at pD=7.4 and 295 K; monitoring by NMR;

Reference： [1]Dickins, Rachel S.; Batsanov, Andrei S.; Howard, Judith A.K.; Parker, David; Puschmann, Horst; Salamano, Stefania [Dalton Transactions, 2004, # 1, p. 70 - 80]

22
[ 29022-11-5 ]
[ 116611-64-4 ]
[ 2489-13-6 ]

Yield	Reaction Conditions	Operation in experiment
	Stage #1: (9-fluorenylmethoxycarbonyl)-L-histidine With benzotriazol-1-ol; O-(benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate; N-ethyl-N,N-diisopropylamine In 1-methyl-pyrrolidin-2-one; N,N-dimethyl-formamide Automated synthesizer; solid phase reaction; Stage #2: With piperidine In 1-methyl-pyrrolidin-2-one; N,N-dimethyl-formamide for 0.216667h; Automated synthesizer; solid phase reaction; Stage #3: N-(fluoren-9-ylmethoxycarbonyl)glycine Further stages;

Reference： [1]Stadlbauer, Stefan; Riechers, Alexander; Spaeth, Andreas; Koenig, Burkhard [Chemistry - A European Journal, 2008, vol. 14, # 8, p. 2536 - 2541]

23
gold(III) tetrachloride trihydrate [ No CAS ]
[ 2489-13-6 ]
[ 7697-37-2 ]
[Au(Gly-L-His-N_A,N_P,N₃)Cl]NO₃*1.25H₂O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
48%	In water dipeptide dissolved in H2O; pH adjusted to 1.5 by addition of 1 M HNO3; H(AuCl4)*3H2O in H2O added; stirred in the dark at ambient temp. for 10 d; filtered; concd. by slow evapn. of filtrate solvent in the dark at ambient temp.; stored in refrigerator for 3-5 d; filtered; crystals washed with cold acetone; dried in the dark at ambient temp.; elem. anal.;

Reference： [1]Rychlewska, Urszula; Warzajtis, Beata; Gliic, Biljana D.; Ivkovic, Marija D.; Rajkovic, Sneana; Djuran, Milo I. [Dalton Transactions, 2010, vol. 39, # 38, p. 8906 - 8913]

24
[ 2489-13-6 ]
[ 56-40-6 ]
[ 71-00-1 ]

Yield	Reaction Conditions	Operation in experiment
	With 15K⁽¹⁺⁾H⁽¹⁺⁾25H₂O*O₁₂₂P₄W₃₄Zr^(16-); water; hydrogen chloride In water-d2 at 60℃;
	With (Et₂NH₂)₈[{α-PW₁₁O₃₉Zr-(μ-OH)(H₂O)}₂]*7H₂O; water; 3-(trimethylsilyl)propionic-2,2,3,3-d<SUB>4 </SUB>acid sodium salt In water-d2 at 60℃;

Reference： [1]Absillis, Gregory; Parac-Vogt, Tatjana N. [Inorganic Chemistry, 2012, vol. 51, # 18, p. 9902 - 9910,9]
[2]Ly, Hong Giang T.; Absillis, Gregory; Parac-Vogt, Tatjana N. [European Journal of Inorganic Chemistry, 2015, vol. 2015, # 13, p. 2206 - 2215]

25
[AuCl(3-azapentane-1,5-diamine)]Cl₂ [ No CAS ]
[ 2489-13-6 ]
C₁₂H₂₄AuN₇O₃⁽³⁺⁾*3Cl^(1-) [ No CAS ]
C₁₂H₂₅AuN₇O₃⁽³⁺⁾*3Cl^(1-) [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	In water-d2 at 25℃; for 1h;

Reference： [1]Glisic, Biljana D.; Rajkovic, Snezana; Djuran, Milos I. [Journal of Coordination Chemistry, 2013, vol. 66, # 3, p. 424 - 434]

26
[AuCl(3-azapentane-1,5-diamine)]Cl₂ [ No CAS ]
[ 2489-13-6 ]
[Au(Gly-L-His-N_A,N_P,N₃)Cl] [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	Stage #1: [AuCl(3-azapentane-1,5-diamine)]Cl₂; GH In water-d2 at 25℃; for 1h; Stage #2: In water-d2 at 25℃; for 96h;

Reference： [1]Glisic, Biljana D.; Rajkovic, Snezana; Djuran, Milos I. [Journal of Coordination Chemistry, 2013, vol. 66, # 3, p. 424 - 434]

27
potassium tetrachloroaurate(III) [ No CAS ]
[ 2489-13-6 ]
[ 7732-18-5 ]
[ 7697-37-2 ]
[Au(glycyl-L-histidine-N,N',N'')Cl]NO₃*1.25H₂O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
54%	at 37℃; for 120h; Darkness;	Synthesis of the gold(III) complexes General procedure: The gold(III) complexes with L-histidine-containing peptides were synthesized by modificationof previously described methods.20-22 A solution of 0.5 mmol of the corresponding peptide (106.1 mg of Gly-L-His, 113.1 mg of L-Ala-L-His and 134.6 mg of Gly-Gly-L-His)in 5.0 mL of water (pH had previously been adjusted to 2.00-2.50 by addition of 1 M HNO3)was added slowly under stirring to the solution containing an equimolar amount of K[AuCl4](188.9 mg of K[AuCl4] in 3.0 mL of water). The resulting solution was stirred in the dark in awater bath at 37 °C for at least 5 days. Any colloidal gold formed was removed by filtrationand filtrate was left standing in the dark at ambient temperature to evaporate slowly. Theyellow crystals of [Au(Gly-L-His-N,N′,N″)Cl]NO3·1.25H2O (Au1), [Au(L-Ala-L-His--N,N′,N″)Cl]NO3·2.5H2O (Au2) and [Au(Gly-Gly-L-His-N,N′,N″,N′′′)]Cl·H2O (Au3) thatformed after 3-5 days were filtered off, washed with cold acetone, and dried in the dark atambient temperature. The yield was 54 % for Au1 (142.6 mg), 48 % for Au2 (135.5 mg) and44 % for Au3 (113.9 mg). The purity of the complexes was checked by elemental micro analysisand 1H-NMR spectroscopy. These data were all found to be in accordance with those reported previously for the corresponding Au(III) complexes

Reference： [1]Glišić, Biljana D.; Stanić, Zorka D.; Rajković, Snežana; Kojić, Vesna; Bogdanović, Gordana; Djuran, Miloš I. [Journal of the Serbian Chemical Society, 2013, vol. 78, # 12, p. 1911 - 1924]

28
[ 2489-13-6 ]
lead⁽²⁺⁾ cation [ No CAS ]
C₈H₁₂N₄O₃*Pb⁽²⁺⁾ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	at 25℃;

Reference： [1]Farkas, Etelka; Bka, Beta; Szocs, Bla; God, Attila J.; Svg, Imre [Inorganica Chimica Acta, 2014, vol. 423, # PA, p. 242 - 249]

29
[ 2489-13-6 ]
lead⁽²⁺⁾ cation [ No CAS ]
C₈H₁₀N₄O₃^(2-)*Pb⁽²⁺⁾*H⁽¹⁺⁾ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	at 25℃;

Reference： [1]Farkas, Etelka; Bka, Beta; Szocs, Bla; God, Attila J.; Svg, Imre [Inorganica Chimica Acta, 2014, vol. 423, # PA, p. 242 - 249]

30
[ 2489-13-6 ]
lead⁽²⁺⁾ cation [ No CAS ]
C₈H₁₂N₄O₃*Pb⁽²⁺⁾*H⁽¹⁺⁾ [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	at 25℃;

Reference： [1]Farkas, Etelka; Bka, Beta; Szocs, Bla; God, Attila J.; Svg, Imre [Inorganica Chimica Acta, 2014, vol. 423, # PA, p. 242 - 249]

31
[ 7451-76-5 ]
[ 2489-13-6 ]
[ 56-40-6 ]

Yield	Reaction Conditions	Operation in experiment
	With (Et₂NH₂)₈[{α-PW₁₁O₃₉Zr-(μ-OH)(H₂O)}₂]*7H₂O; water; 3-(trimethylsilyl)propionic-2,2,3,3-d<SUB>4 </SUB>acid sodium salt In water-d2 at 60℃;

Reference： [1]Ly, Hong Giang T.; Absillis, Gregory; Parac-Vogt, Tatjana N. [European Journal of Inorganic Chemistry, 2015, vol. 2015, # 13, p. 2206 - 2215]

32
potassium tetrachloroaurate(III) [ No CAS ]
[ 2489-13-6 ]
[ 7732-18-5 ]
[ 7697-37-2 ]
[Au(Gly-L-His-N_A,N_P,N₃)Cl]NO₃*1.25H₂O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
68%	at 20℃; for 168h; Darkness;

Reference： [1]Warzajtis, Beata; Glišić, Biljana D.; Savić, Nada D.; Pavic, Aleksandar; Vojnovic, Sandra; Veselinović, Aleksandar; Nikodinovic-Runic, Jasmina; Rychlewska, Urszula; Djuran, Miloš I. [Dalton Transactions, 2017, vol. 46, # 8, p. 2594 - 2608]

33
[ 7647-01-0 ]
potassium tetrachloroaurate(III) [ No CAS ]
[ 2489-13-6 ]
[ 7732-18-5 ]
{Au(glycyl-L-histidine(-))Cl}Cl*3H₂O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
71%	at 20℃; for 168h; Darkness;

34
potassium tetrachloroaurate(III) [ No CAS ]
[ 2489-13-6 ]
[ 7732-18-5 ]
[Au(Gly-L-His-N_A,N_P,N₃)Cl]NO₃*1.25H₂O [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
46%	With nitric acid at 37℃; for 120h; Darkness;	[Au(Gly-L-His)Cl]NO31.25H2O (1e), [Au(L-Ala-L-His)Cl]NO3-2.5H2O (1f) and [Au(Gly-Gly-L-His)]ClH2O (1g). The correspondingpeptide (0.5 mmol; 106 mg of Gly-L-His, 113 mg of L-Ala-L-Hisor 134 mg of Gly-Gly-L-His) was dissolved in 5.0 mL of water,adjusted to pH 2.00-2.50 with 1 M HNO3. An equimolar amountof K[AuCl4] (189 mg) dissolved in 5.0 mL of water was slowlyadded to the stirred solution of the peptide. The resulting yellowsolution was stirred in a water bath at 37 °C for five days in thedark. Any colloidal gold that formed was removed by filtrationand the filtrate was left to slowly evaporate to a volume of ca. 3mL at ambient temperature in the dark. The concentrated solutionwas then stored in a refrigerator and yellow crystals of 1e-gformed after 3-5 days. These crystals were filtered off and driedin the dark at ambient temperature. The yield was 52% for 1e(137 mg), 46% for 1f (130 mg) and 42% for 1g (109 mg).Anal. Calc. for 1e (C8H13.50AuClN5O7.25; Mr = 528.14): C, 18.19;H, 2.58; N, 13.26. Found: C, 18.54; H, 2.46; N, 13.02%. 1H NMR(200 MHz, D2O): δ = 3.11 (dd, J = 15.8, 4.3 Hz, HisbCH2), 3.60 (dd,J = 15.8, 4.3 Hz, Hisb0CH2), 4.03 (d, J = 17.0 Hz, GlyCH2), 3.99 (d, J= 17.0 Hz, GlyCH20), 4.71 (t, J = 4.3 Hz, HisaCH), 7.31 (s, HisC5H),8.56 ppm (s, HisC2H). 13C NMR (50 MHz, D2O): δ = 33.07 (HisbCH2),50.41 (GlyCH2), 56.36 (HisaCH), 118.72 (HisC5), 130.60 (HisC4),139.80 (HisC2), 177.14 (GlyCO), 187.04 ppm (HisCOOH). IR (KBr,m, cm-1): 3409br, 3183, 3120, 3032, 2920br, 1731 s, 1654vs,1527w, 1507w, 1426m, 1384vs, 1342m, 1278m, 1174s, 1124m, 1086w, 1033w, 980w, 950w, 922w, 853m, 824w, 803m, 699m,630m, 553w, 505m. UV-Vis (H2O, λmax, nm): 284.0 (e = 6.2 102M-1 cm-1).

Reference： [1]Radulović, Niko S.; Stojanović, Nikola M.; Glišić, Biljana Đ.; Randjelović, Pavle J.; Stojanović-Radić, Zorica Z.; Mitić, Katarina V.; Nikolić, Milica G.; Djuran, Miloš I. [Polyhedron, 2018, vol. 141, p. 164 - 180]

35
dichloro(1,2-diaminoethane)gold(III) chloride dihydrate [ No CAS ]
[ 2489-13-6 ]
[Au(Gly-L-His-N_A,N_P,N₃)Cl] [ No CAS ]

Yield	Reaction Conditions	Operation in experiment
	at 25℃;