N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y503-1451 |
| Compound Name: | N-{1-[(2,4-dichlorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 462.28 |
| Molecular Formula: | C17 H12 Cl2 F3 N5 O S |
| Smiles: | C(c1ccc(cc1[Cl])[Cl])n1ccc(NC(CSc2nccc(C(F)(F)F)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3556 |
| logD: | 4.3549 |
| logSw: | -4.414 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.797 |
| InChI Key: | ZDUHRGHNVLCKJM-UHFFFAOYSA-N |