ethyl 5-cyano-4-(3-methylthiophen-2-yl)-2-phenyl-6-[(prop-2-en-1-yl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-4-(3-methylthiophen-2-yl)-2-phenyl-6-[(prop-2-en-1-yl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
ethyl 5-cyano-4-(3-methylthiophen-2-yl)-2-phenyl-6-[(prop-2-en-1-yl)sulfanyl]-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | D360-2276 |
| Compound Name: | ethyl 5-cyano-4-(3-methylthiophen-2-yl)-2-phenyl-6-[(prop-2-en-1-yl)sulfanyl]-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 422.57 |
| Molecular Formula: | C23 H22 N2 O2 S2 |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SCC=C)c1c(C)ccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.6702 |
| logD: | 0.9139 |
| logSw: | -5.4411 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.104 |
| InChI Key: | GEEIYDUDIHCHBW-GOSISDBHSA-N |