ethyl 4-(2-chlorophenyl)-5-cyano-6-(methylsulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 4-(2-chlorophenyl)-5-cyano-6-(methylsulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
ethyl 4-(2-chlorophenyl)-5-cyano-6-(methylsulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | C212-0015 |
| Compound Name: | ethyl 4-(2-chlorophenyl)-5-cyano-6-(methylsulfanyl)-2-phenyl-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 410.92 |
| Molecular Formula: | C22 H19 Cl N2 O2 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SC)c1ccccc1[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5169 |
| logD: | 0.7109 |
| logSw: | -5.8814 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.085 |
| InChI Key: | JJGHNIUPCRQTLF-GOSISDBHSA-N |