N-tert-butyl-2-{[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-tert-butyl-2-{[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetamide
N-tert-butyl-2-{[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | D360-0399 |
| Compound Name: | N-tert-butyl-2-{[3-cyano-6-(4-methylphenyl)pyridin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 339.46 |
| Molecular Formula: | C19 H21 N3 O S |
| Smiles: | Cc1ccc(cc1)c1ccc(C#N)c(n1)SCC(NC(C)(C)C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5431 |
| logD: | 4.5431 |
| logSw: | -4.3204 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.066 |
| InChI Key: | IRXPMYBPUCKJPX-UHFFFAOYSA-N |