2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
Chemical Structure Depiction of
2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide
Compound characteristics
| Compound ID: | K781-3631 |
| Compound Name: | 2-{[2-(2,4-dimethoxyanilino)-2-oxoethyl]sulfanyl}-N-[(4-methylphenyl)methyl]pyridine-3-carboxamide |
| Molecular Weight: | 451.54 |
| Molecular Formula: | C24 H25 N3 O4 S |
| Smiles: | Cc1ccc(CNC(c2cccnc2SCC(Nc2ccc(cc2OC)OC)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.6332 |
| logD: | 3.6331 |
| logSw: | -3.9131 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 71.185 |
| InChI Key: | KPILWNZADNTXNI-UHFFFAOYSA-N |