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Structure of 882562-40-5

Chemical Structure| 882562-40-5

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Product Details of [ 882562-40-5 ]

CAS No. :882562-40-5
Formula : C18H11Cl2N3O2S
M.W : 404.27
SMILES Code : ClC1=NC(C2=CN(C3=C2C=CC=C3)S(=O)(=O)C2=CC=CC=C2)=C(Cl)C=N1
MDL No. :MFCD17392847
InChI Key :ZSDGZYGEBQECGY-UHFFFAOYSA-N
Pubchem ID :70700794

Safety of [ 882562-40-5 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P261-P305+P351+P338

Application In Synthesis of [ 882562-40-5 ]

* 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 [ 882562-40-5 ]

[ 882562-40-5 ] Synthesis Path-Downstream   1~2

  • 1
  • [ 882562-40-5 ]
  • [ 1239589-52-6 ]
  • N2-(5-chloro-4-(1-(phenylsulfonyl)-1H-indol-3-yl)pyrimidin-2-yl)spiro[3.3]heptane-2,6-diamine [ No CAS ]
YieldReaction ConditionsOperation in experiment
35% In 1,2-dimethoxyethane; dichloromethane; at 85℃; for 16h;Sealed tube; N2-(5-chloro-4-(1-(phenylsulfonyl)-1H-indol-3-yl)pyrimidin-2-yl)spiro[3.3]heptane-2,6-diamineA 20 mL scintillation vial was charged with 3-(2,5-dichloropyrimidin-4-yl)-1-(phenylsulfonyl)-1H-indole (170 mg, 0.42 mmol) and <strong>[1239589-52-6]tert-butyl (6-aminospiro[3.3]heptan-2-yl)carbamate</strong> (113 mg, 0.5 mmol). Reagents were suspended in a mixture of DME (3.4 mL) and DCM (0.8 mL). The vial was sealed and heated to 85 C for 16 h. Upon completion (with concomitant Boc deprotection) the reaction was cooled and concentrated. The residue was purified by Si02chromatography (MeOH/DCM gradient 0-15%) to afford the title compound (71.5 mg, 0.145 mmol, 35%) as a white solid.
  • 2
  • [ 882562-40-5 ]
  • [ 162167-97-7 ]
  • tert-butyl 3-((5-chloro-4-(1-(phenylsulfonyl)-1H-indol-3-yl)pyrimidin-2-ylamino)methyl)piperidine-1-carboxylate [ No CAS ]
YieldReaction ConditionsOperation in experiment
85% With N-ethyl-N,N-diisopropylamine; In 1-methyl-pyrrolidin-2-one; at 135℃; for 0.416667h;Microwave irradiation; tert-butyl 3-((5-chloro-4-(1-(phenylsulfonyl)-1H-indol-3-yl)pyrimidin-2-ylamino)methyl)piperidine-1-carboxylateA solution of 3-(2,5-dichloropyrimidin-4-yl)-l-(phenylsulfonyl)-lH-indole (300mg, 0.74mmol), l-Boc-3-(aminomethyl)piperidine (159mg, 0.74mmol) and diisopropylethylamine (0.13 mL, 0.74 mmol) in NMP (2.0mL) was heated 25min at 135°C (mW). The mixture was diluted with EtOAc (30mL), washed with water (3x5mL), brine (5mL), dried (MgS04), filtered, and concentrated under reduced pressure. The residue was purified by Si02 chromatography (DCM/EtOAc 0 to 15percent gradient), and afforded the title compound (355mg, 0.67mmol, 85percent) as a white solid.
 

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