2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-N-(4-methoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
Chemical Structure Depiction of
2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-N-(4-methoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-N-(4-methoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | D276-0445 |
| Compound Name: | 2-{[2-(2-chloroanilino)-2-oxoethyl]sulfanyl}-N-(4-methoxyphenyl)-4,6-dimethylpyridine-3-carboxamide |
| Molecular Weight: | 455.96 |
| Molecular Formula: | C23 H22 Cl N3 O3 S |
| Smiles: | Cc1cc(C)nc(c1C(Nc1ccc(cc1)OC)=O)SCC(Nc1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 4.5781 |
| logD: | 4.5766 |
| logSw: | -4.7183 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.607 |
| InChI Key: | IUBKNRBLQJRBJE-UHFFFAOYSA-N |