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[ CAS No. 20815-52-5 ] 4-Hydrazinylpyridine hydrochloride

Cat. No.: A115132
Chemical Structure| 20815-52-5
Chemical Structure| 20815-52-5
Structure of 20815-52-5 * Storage: Inert atmosphere,2-8°C
Purity Size Price USA Stock *0-1 Day Global Stock *5-7 Days Quantity
95% 250mg $5.00 Inquiry Inquiry
95% 1g $6.00 Inquiry Inquiry
95% 5g $16.00 Inquiry Inquiry
95% 25g $58.00 Inquiry Inquiry
95% 100g $220.00 Inquiry Inquiry
95% 500g $772.00 Inquiry Inquiry

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Product Details of [ 20815-52-5 ]

CAS No. :20815-52-5 MDL No. :MFCD00035353
Formula : C5H8ClN3 Boiling Point : -
Linear Structure Formula :- InChI Key :MMLHRYAPGSEXCA-UHFFFAOYSA-N
M.W : 145.59 Pubchem ID :22320258
Synonyms :

Calculated chemistry of [ 20815-52-5 ]      Expand+

Physicochemical Properties

Num. heavy atoms : 9
Num. arom. heavy atoms : 6
Fraction Csp3 : 0.0
Num. rotatable bonds : 1
Num. H-bond acceptors : 2.0
Num. H-bond donors : 2.0
Molar Refractivity : 38.41
TPSA : 50.94 Ų

Pharmacokinetics

GI absorption : High
BBB permeant : Yes
P-gp substrate : No
CYP1A2 inhibitor : No
CYP2C19 inhibitor : No
CYP2C9 inhibitor : No
CYP2D6 inhibitor : No
CYP3A4 inhibitor : No
Log Kp (skin permeation) : -6.56 cm/s

Lipophilicity

Log Po/w (iLOGP) : 0.0
Log Po/w (XLOGP3) : 0.89
Log Po/w (WLOGP) : 0.98
Log Po/w (MLOGP) : 0.06
Log Po/w (SILICOS-IT) : -0.05
Consensus Log Po/w : 0.38

Druglikeness

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

Water Solubility

Log S (ESOL) : -1.73
Solubility : 2.71 mg/ml ; 0.0186 mol/l
Class : Very soluble
Log S (Ali) : -1.54
Solubility : 4.16 mg/ml ; 0.0285 mol/l
Class : Very soluble
Log S (SILICOS-IT) : -1.65
Solubility : 3.24 mg/ml ; 0.0222 mol/l
Class : Soluble

Medicinal Chemistry

PAINS : 0.0 alert
Brenk : 1.0 alert
Leadlikeness : 1.0
Synthetic accessibility : 1.37

Safety of [ 20815-52-5 ]

Signal Word:Warning Class:N/A
Precautionary Statements:P261-P280-P305+P351+P338 UN#:N/A
Hazard Statements:H302-H315-H319-H332-H335 Packing Group:N/A
GHS Pictogram:
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