ethyl 5-cyano-2-methyl-6-(methylsulfanyl)-4-phenyl-1,4-dihydropyridine-3-carboxylate
Chemical Structure Depiction of
ethyl 5-cyano-2-methyl-6-(methylsulfanyl)-4-phenyl-1,4-dihydropyridine-3-carboxylate
ethyl 5-cyano-2-methyl-6-(methylsulfanyl)-4-phenyl-1,4-dihydropyridine-3-carboxylate
Compound characteristics
| Compound ID: | 4155-0114 |
| Compound Name: | ethyl 5-cyano-2-methyl-6-(methylsulfanyl)-4-phenyl-1,4-dihydropyridine-3-carboxylate |
| Molecular Weight: | 314.4 |
| Molecular Formula: | C17 H18 N2 O2 S |
| Smiles: | CCOC(C1C(C(C#N)=C(NC=1C)SC)c1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4206 |
| logD: | -0.0123 |
| logSw: | -3.484 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.856 |
| InChI Key: | MWAFUYZPEXGPIM-HNNXBMFYSA-N |