N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-({4-[4-(difluoromethoxy)phenyl]pyrimidin-2-yl}sulfanyl)acetamide
Chemical Structure Depiction of
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-({4-[4-(difluoromethoxy)phenyl]pyrimidin-2-yl}sulfanyl)acetamide
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-({4-[4-(difluoromethoxy)phenyl]pyrimidin-2-yl}sulfanyl)acetamide
Compound characteristics
| Compound ID: | Y502-7149 |
| Compound Name: | N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-({4-[4-(difluoromethoxy)phenyl]pyrimidin-2-yl}sulfanyl)acetamide |
| Molecular Weight: | 519.93 |
| Molecular Formula: | C23 H17 Cl F3 N5 O2 S |
| Smiles: | C(c1c(cccc1[Cl])F)n1ccc(NC(CSc2nccc(c3ccc(cc3)OC(F)F)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.7702 |
| logD: | 4.7695 |
| logSw: | -4.9427 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.131 |
| InChI Key: | VUHHRUKWJVLGJZ-UHFFFAOYSA-N |