4-(2-chlorophenyl)-N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
4-(2-chlorophenyl)-N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
4-(2-chlorophenyl)-N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 2188-2041 |
| Compound Name: | 4-(2-chlorophenyl)-N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(4-methylphenyl)-2-oxoethyl]sulfanyl}-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 548.49 |
| Molecular Formula: | C29 H23 Cl2 N3 O2 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(c1ccc(C)cc1)=O)c1ccccc1[Cl])C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8722 |
| logD: | 6.389 |
| logSw: | -6.2484 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 63.169 |
| InChI Key: | QKZAMZQQQAUSAU-HHHXNRCGSA-N |