6-[(2-Amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-N-phenyl-1,4-dihydro[4,4'-bipyridine]-3-carboxamide

Base Information

• Chemical Name: 6-[(2-Amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-N-phenyl-1,4-dihydro[4,4'-bipyridine]-3-carboxamide
• CAS No.: 5231-55-0
• Molecular Formula: C21H19N5O2S
• DSSTox Substance ID: DTXSID10385456

Synonyms:5231-55-0;CBMicro_014737;Oprea1_132059;Oprea1_446016;DTXSID10385456;SMSF0005027;STK835059;AKOS000522939;CB13583;BIM-0014729.P001;6-[(2-amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-N-phenyl-1,4-dihydro-4,4'-bipyridine-3-carboxamide;6-[(2-Amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-N-phenyl-1,4-dihydro[4,4'-bipyridine]-3-carboxamide

Chemical Property of 6-[(2-Amino-2-oxoethyl)sulfanyl]-5-cyano-2-methyl-N-phenyl-1,4-dihydro[4,4'-bipyridine]-3-carboxamide

Chemical Property:

• XLogP3: 1.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 405.12594604
• Heavy Atom Count: 29
• Complexity: 754

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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=CC=NC=C2)C(=O)NC3=CC=CC=C3

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