5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8010-9970 |
| Compound Name: | 5-cyano-6-{[2-(2-ethylanilino)-2-oxoethyl]sulfanyl}-2-methyl-N-(2-methylphenyl)-4-(thiophen-2-yl)-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 528.7 |
| Molecular Formula: | C29 H28 N4 O2 S2 |
| Smiles: | CCc1ccccc1NC(CSC1=C(C#N)C(C(=C(C)N1)C(Nc1ccccc1C)=O)c1cccs1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.1132 |
| logD: | 4.2722 |
| logSw: | -4.8589 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 72.694 |
| InChI Key: | HCYWKQZFDUIIIH-MHZLTWQESA-N |