AC1MNXTI
ethyl 6-(2-anilino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Also Known As: ChemDiv3_008286|IDI1_026196|ETHYL 5-CYANO-4-(FURAN-2-YL)-2-PHENYL-6-{[(PHENYLCARBAMOYL)METHYL]SULFANYL}-1,4-DIHYDROPYRIDINE-3-CARBOXYLATE|ethyl 5-cyano-4-(furan-2-yl)-6-((2-oxo-2-(phenylamino)ethyl)thio)-2-phenyl-1,4-dihydropyridine-3-carboxylate|ethyl 5-cyano-4-(furan-2-yl)-6-{[2-oxo-2-(phenylamino)ethyl]sulfanyl}-2-phenyl-1,4-dihydropyridine-3-carboxylate|ethyl 6-(2-anilino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
| Molecular Formula | C27H23N3O4S |
|---|---|
| Molecular Weight | 485.14093 g/mol |
| LogP | 5.04788 |
| Topological Polar Surface Area | 104.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 485.14093 |
| Monoisotopic Mass | 485.14093 |
| Heavy Atoms | 35 |
| Complexity | 1293.209 |
Chemical Identifiers
| CAS Number | 796879-75-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(NC(=C(C1C2=CC=CO2)C#N)SCC(=O)NC3=CC=CC=C3)C4=CC=CC=C4 |
Product Overview
AC1MNXTI (CAS 796879-75-9), with molecular formula C27H23N3O4S and molecular weight 485.14093 g/mol. IUPAC: ethyl 6-(2-anilino-2-oxoethyl)sulfanyl-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate.