N-{1-[(2,6-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-{1-[(2,6-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
N-{1-[(2,6-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y508-8951 |
| Compound Name: | N-{1-[(2,6-dichlorophenyl)methyl]-1H-pyrazol-4-yl}-2-{[4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 570.42 |
| Molecular Formula: | C23 H20 Cl2 F3 N7 O S |
| Smiles: | CCn1cc(c2cc(C(F)(F)F)nc(n2)SCC(Nc2cnn(Cc3c(cccc3[Cl])[Cl])c2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.8179 |
| logD: | 4.8176 |
| logSw: | -4.8767 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.498 |
| InChI Key: | VVHFFJXWTSHNIE-UHFFFAOYSA-N |