N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(3-methylanilino)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(3-methylanilino)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridine-3-carboxamide
N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(3-methylanilino)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridine-3-carboxamide
Compound characteristics
| Compound ID: | 8011-7443 |
| Compound Name: | N-(4-chlorophenyl)-5-cyano-2-methyl-6-{[2-(3-methylanilino)-2-oxoethyl]sulfanyl}-4-phenyl-1,4-dihydropyridine-3-carboxamide |
| Molecular Weight: | 529.06 |
| Molecular Formula: | C29 H25 Cl N4 O2 S |
| Smiles: | CC1=C(C(C(C#N)=C(N1)SCC(Nc1cccc(C)c1)=O)c1ccccc1)C(Nc1ccc(cc1)[Cl])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.8743 |
| logD: | 5.1601 |
| logSw: | -6.1053 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 73.071 |
| InChI Key: | UHTZTMIVKGRCEH-HHHXNRCGSA-N |