ethyl 5-cyano-2-phenyl-6-[(prop-2-en-1-yl)sulfanyl]-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-2-phenyl-6-[(prop-2-en-1-yl)sulfanyl]-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
ethyl 5-cyano-2-phenyl-6-[(prop-2-en-1-yl)sulfanyl]-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | D360-2431 |
| Compound Name: | ethyl 5-cyano-2-phenyl-6-[(prop-2-en-1-yl)sulfanyl]-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 408.54 |
| Molecular Formula: | C22 H20 N2 O2 S2 |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1c1ccccc1)SCC=C)c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1009 |
| logD: | 0.3446 |
| logSw: | -4.8463 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.104 |
| InChI Key: | NCCZVLJCSBHVTE-SFHVURJKSA-N |