N-tert-butyl-2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-tert-butyl-2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
N-tert-butyl-2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8001-7241 |
| Compound Name: | N-tert-butyl-2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 331.36 |
| Molecular Formula: | C14 H16 F3 N3 O S |
| Smiles: | Cc1cc(c(C#N)c(n1)SCC(NC(C)(C)C)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.164 |
| logD: | 3.164 |
| logSw: | -3.3698 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.144 |
| InChI Key: | JIGREOAFYCOJOD-UHFFFAOYSA-N |