2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-phenylacetamide
Chemical Structure Depiction of
2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-phenylacetamide
2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-phenylacetamide
Compound characteristics
| Compound ID: | 8001-1404 |
| Compound Name: | 2-{[3-cyano-6-methyl-4-(trifluoromethyl)pyridin-2-yl]sulfanyl}-N-phenylacetamide |
| Molecular Weight: | 351.35 |
| Molecular Formula: | C16 H12 F3 N3 O S |
| Smiles: | Cc1cc(c(C#N)c(n1)SCC(Nc1ccccc1)=O)C(F)(F)F |
| Stereo: | ACHIRAL |
| logP: | 3.5619 |
| logD: | 3.5619 |
| logSw: | -4.0075 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.726 |
| InChI Key: | XSLUVVQQOBJLET-UHFFFAOYSA-N |