ethyl 5-cyano-6-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-6-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
ethyl 5-cyano-6-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | C212-0083 |
| Compound Name: | ethyl 5-cyano-6-({2-[4-(ethoxycarbonyl)anilino]-2-oxoethyl}sulfanyl)-4-(furan-2-yl)-2-phenyl-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 557.63 |
| Molecular Formula: | C30 H27 N3 O6 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SCC(Nc1ccc(cc1)C(=O)OCC)=O)c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4731 |
| logD: | 0.814 |
| logSw: | -5.5338 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 100.295 |
| InChI Key: | CXJUPQJTCWARAL-RUZDIDTESA-N |