AC1MXVE3
5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-phenacylsulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Also Known As: Oprea1_254258|Oprea1_584739|5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-phenacylsulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide|5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-((2-oxo-2-phenylethyl)thio)-N-phenyl-1,4-dihydropyridine-3-carboxamide|5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-[(2-oxo-2-phenylethyl)sulfanyl]-N-phenyl-1,4-dihydropyridine-3-carboxamide
| Molecular Formula | C30H27N3O3S |
|---|---|
| Molecular Weight | 509.1773 g/mol |
| LogP | 6.03608 |
| Topological Polar Surface Area | 91.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 9 |
| Exact Mass | 509.1773 |
| Monoisotopic Mass | 509.1773 |
| Heavy Atoms | 37 |
| Complexity | 1375.0789 |
Chemical Identifiers
| CAS Number | 684231-25-2 |
|---|---|
| SMILES | CCOC1=CC=C(C=C1)C2C(=C(NC(=C2C(=O)NC3=CC=CC=C3)C)SCC(=O)C4=CC=CC=C4)C#N |
Product Overview
AC1MXVE3 (CAS 684231-25-2), with molecular formula C30H27N3O3S and molecular weight 509.1773 g/mol. IUPAC: 5-cyano-4-(4-ethoxyphenyl)-2-methyl-6-phenacylsulfanyl-N-phenyl-1,4-dihydropyridine-3-carboxamide.
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