N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y503-1456 |
| Compound Name: | N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 445.82 |
| Molecular Formula: | C17 H12 Cl F4 N5 O S |
| Smiles: | C(c1c(cccc1[Cl])F)n1ccc(NC(CSc2nccc(C(F)(F)F)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.5975 |
| logD: | 3.5969 |
| logSw: | -3.8369 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.797 |
| InChI Key: | MDGFSRUVYJLZQK-UHFFFAOYSA-N |