N-(4-ethylphenyl)-4,6-dimethyl-2-{[2-(3-methylanilino)-2-oxoethyl]sulfanyl}pyridine-3-carboxamide
Chemical Structure Depiction of
N-(4-ethylphenyl)-4,6-dimethyl-2-{[2-(3-methylanilino)-2-oxoethyl]sulfanyl}pyridine-3-carboxamide
N-(4-ethylphenyl)-4,6-dimethyl-2-{[2-(3-methylanilino)-2-oxoethyl]sulfanyl}pyridine-3-carboxamide
Compound characteristics
| Compound ID: | D276-0813 |
| Compound Name: | N-(4-ethylphenyl)-4,6-dimethyl-2-{[2-(3-methylanilino)-2-oxoethyl]sulfanyl}pyridine-3-carboxamide |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C25 H27 N3 O2 S |
| Smiles: | CCc1ccc(cc1)NC(c1c(C)cc(C)nc1SCC(Nc1cccc(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8355 |
| logD: | 5.8346 |
| logSw: | -5.4029 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.761 |
| InChI Key: | YTXXOPDOODPGSK-UHFFFAOYSA-N |