2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-N-(4-ethoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
Chemical Structure Depiction of
2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-N-(4-ethoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-N-(4-ethoxyphenyl)-4,6-dimethylpyridine-3-carboxamide
Compound characteristics
| Compound ID: | D276-0640 |
| Compound Name: | 2-{[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl}-N-(4-ethoxyphenyl)-4,6-dimethylpyridine-3-carboxamide |
| Molecular Weight: | 484.02 |
| Molecular Formula: | C25 H26 Cl N3 O3 S |
| Smiles: | CCOc1ccc(cc1)NC(c1c(C)cc(C)nc1SCC(Nc1ccc(C)c(c1)[Cl])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3041 |
| logD: | 6.3026 |
| logSw: | -6.3793 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 61.885 |
| InChI Key: | JJZKMHGDAIMIPX-UHFFFAOYSA-N |