5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8011-7396 |
| Compound Name: | 5-cyano-6-{[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(2-ethoxyphenyl)-2-methyl-N-phenyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 552.7 |
| Molecular Formula: | C32 H32 N4 O3 S |
| Smiles: | CCOc1ccccc1C1C(C#N)=C(NC(C)=C1C(Nc1ccccc1)=O)SCC(Nc1ccc(C)cc1C)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.824 |
| logD: | 5.1098 |
| logSw: | -5.3399 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 79.583 |
| InChI Key: | UTIUOYDYCXDNJM-PMERELPUSA-N |