ethyl 6-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 6-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
ethyl 6-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | C212-0118 |
| Compound Name: | ethyl 6-{[2-(4-acetylanilino)-2-oxoethyl]sulfanyl}-5-cyano-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 527.6 |
| Molecular Formula: | C29 H25 N3 O5 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SCC(Nc1ccc(cc1)C(C)=O)=O)c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4137 |
| logD: | -0.2453 |
| logSw: | -4.1489 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 93.368 |
| InChI Key: | CSYSLYUCPOZSGX-RUZDIDTESA-N |