2-{[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4,6-dimethyl-N-(4-methylphenyl)pyridine-3-carboxamide
Chemical Structure Depiction of
2-{[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4,6-dimethyl-N-(4-methylphenyl)pyridine-3-carboxamide
2-{[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4,6-dimethyl-N-(4-methylphenyl)pyridine-3-carboxamide
Compound characteristics
| Compound ID: | D276-0083 |
| Compound Name: | 2-{[2-(3,4-dimethylanilino)-2-oxoethyl]sulfanyl}-4,6-dimethyl-N-(4-methylphenyl)pyridine-3-carboxamide |
| Molecular Weight: | 433.57 |
| Molecular Formula: | C25 H27 N3 O2 S |
| Smiles: | Cc1ccc(cc1)NC(c1c(C)cc(C)nc1SCC(Nc1ccc(C)c(C)c1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.9557 |
| logD: | 5.9548 |
| logSw: | -5.4307 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.761 |
| InChI Key: | PFRRQMUDNGXIRV-UHFFFAOYSA-N |