AC1MDESH
6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide
Also Known As: CBMicro_014737|Oprea1_132059|Oprea1_446016|BAS 00635128|BIM-0014729.P001|AE-848/34089004|6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide|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)thio]-5-cyano-2-methyl-N-phenyl-1,4-dihydro-4,4'-bipyridine-3-carboxamide|6-((2-amino-2-oxoethyl)thio)-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|6-[(carbamoylmethyl)sulfanyl]-5-cyano-2-methyl-N-phenyl-4-(pyridin-4-yl)-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C21H19N5O2S |
|---|---|
| Molecular Weight | 405.12595 g/mol |
| LogP | 2.63478 |
| Topological Polar Surface Area | 120.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 405.12595 |
| Monoisotopic Mass | 405.12595 |
| Heavy Atoms | 29 |
| Complexity | 1026.0419 |
Chemical Identifiers
| CAS Number | 201274-15-9 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)N)C#N)C2=CC=NC=C2)C(=O)NC3=CC=CC=C3 |
Product Overview
AC1MDESH (CAS 201274-15-9), with molecular formula C21H19N5O2S and molecular weight 405.12595 g/mol. IUPAC: 6-(2-amino-2-oxoethyl)sulfanyl-5-cyano-2-methyl-N-phenyl-4-pyridin-4-yl-1,4-dihydropyridine-3-carboxamide.
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