ethyl 5-cyano-4-(furan-2-yl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-4-(furan-2-yl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate
ethyl 5-cyano-4-(furan-2-yl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | D360-2014 |
| Compound Name: | ethyl 5-cyano-4-(furan-2-yl)-6-[(2-methoxy-2-oxoethyl)sulfanyl]-2-phenyl-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 424.47 |
| Molecular Formula: | C22 H20 N2 O5 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SCC(=O)OC)c1ccco1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4917 |
| logD: | -1.1674 |
| logSw: | -3.6032 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.243 |
| InChI Key: | MTVXPDRGUUTXPT-GOSISDBHSA-N |