N-(4-chlorophenyl)-5-cyano-6-{[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide
Chemical Structure Depiction of
N-(4-chlorophenyl)-5-cyano-6-{[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide
N-(4-chlorophenyl)-5-cyano-6-{[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | 4296-0593 |
| Compound Name: | N-(4-chlorophenyl)-5-cyano-6-{[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide |
| Molecular Weight: | 571.1 |
| Molecular Formula: | C31 H27 Cl N4 O3 S |
| Smiles: | Cc1ccc(cc1C)NC(CSc1c(C#N)c(c2ccc(cc2)OC)c(C(Nc2ccc(cc2)[Cl])=O)c(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 7.4674 |
| logD: | 7.4374 |
| logSw: | -6.5636 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.86 |
| InChI Key: | RFSMDZMIYQFPIA-UHFFFAOYSA-N |