ethyl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
ethyl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | D360-2424 |
| Compound Name: | ethyl 5-cyano-6-[(2-ethoxy-2-oxoethyl)sulfanyl]-2-phenyl-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 454.57 |
| Molecular Formula: | C23 H22 N2 O4 S2 |
| Smiles: | CCOC(CSC1=C(C#N)C(C(=C(c2ccccc2)N1)C(=O)OCC)c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5061 |
| logD: | -0.153 |
| logSw: | -4.1038 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.262 |
| InChI Key: | YEHRWNFILDIETB-IBGZPJMESA-N |