ethyl 5-cyano-4-(furan-2-yl)-6-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-4-(furan-2-yl)-6-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
ethyl 5-cyano-4-(furan-2-yl)-6-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | C212-0080 |
| Compound Name: | ethyl 5-cyano-4-(furan-2-yl)-6-({2-oxo-2-[2-(trifluoromethyl)anilino]ethyl}sulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 553.56 |
| Molecular Formula: | C28 H22 F3 N3 O4 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SCC(Nc1ccccc1C(F)(F)F)=O)c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.3873 |
| logD: | 0.7282 |
| logSw: | -5.3965 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.844 |
| InChI Key: | PQOVRSSRFAOZSL-HSZRJFAPSA-N |