AC1ME8NR
4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-phenacylsulfanyl-1,4-dihydropyridine-3-carboxamide
Also Known As: CBMicro_022752|Oprea1_604404|Oprea1_619088|BAS 00865920|BIM-0022991.P001|4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydropyridine-3-carboxamide|AG-690/12888665|SR-01000427326-1|F0837-0148|4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-((2-oxo-2-phenylethyl)thio)-1,4-dihydropyridine-3-carboxamide|4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-phenacylsulfanyl-1,4-dihydropyridine-3-carboxamide|[4-(2-chlorophenyl)-5-cyano-2-methyl-6-(2-oxo-2-phenylethylthio)(3-1,4-dihydro pyridyl)]-N-(2-methoxyphenyl)carboxamide|4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-[(2-oxo-2-phenylethyl)sulfanyl]-1,4-dihydro-3-pyridinecarboxamide|4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-[(2-oxo-2-phenylethyl)thio]-1,4-dihydro-3-pyridinecarboxamide
| Molecular Formula | C29H24ClN3O3S |
|---|---|
| Molecular Weight | 529.1227 g/mol |
| LogP | 6.29938 |
| Topological Polar Surface Area | 91.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 529.1227 |
| Monoisotopic Mass | 529.1227 |
| Heavy Atoms | 37 |
| Complexity | 1444.0059 |
Chemical Identifiers
| CAS Number | 5530-85-8 |
|---|---|
| SMILES | CC1=C(C(C(=C(N1)SCC(=O)C2=CC=CC=C2)C#N)C3=CC=CC=C3Cl)C(=O)NC4=CC=CC=C4OC |
Product Overview
AC1ME8NR (CAS 5530-85-8), with molecular formula C29H24ClN3O3S and molecular weight 529.1227 g/mol. IUPAC: 4-(2-chlorophenyl)-5-cyano-N-(2-methoxyphenyl)-2-methyl-6-phenacylsulfanyl-1,4-dihydropyridine-3-carboxamide.
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