6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-N-(4-chlorophenyl)-5-cyano-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide
Chemical Structure Depiction of
6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-N-(4-chlorophenyl)-5-cyano-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide
6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-N-(4-chlorophenyl)-5-cyano-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | 4296-0607 |
| Compound Name: | 6-{[2-(3-chloroanilino)-2-oxoethyl]sulfanyl}-N-(4-chlorophenyl)-5-cyano-4-(4-methoxyphenyl)-2-methylpyridine-3-carboxamide |
| Molecular Weight: | 577.49 |
| Molecular Formula: | C29 H22 Cl2 N4 O3 S |
| Smiles: | Cc1c(C(Nc2ccc(cc2)[Cl])=O)c(c2ccc(cc2)OC)c(C#N)c(n1)SCC(Nc1cccc(c1)[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 7.2336 |
| logD: | 7.2036 |
| logSw: | -6.4615 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.86 |
| InChI Key: | VQEDTLPQGRMUEJ-UHFFFAOYSA-N |