N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-{[4-(4-fluorophenyl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-{[4-(4-fluorophenyl)pyrimidin-2-yl]sulfanyl}acetamide
N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-{[4-(4-fluorophenyl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y502-7659 |
| Compound Name: | N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-{[4-(4-fluorophenyl)pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 453.92 |
| Molecular Formula: | C22 H17 Cl F N5 O S |
| Smiles: | C(c1ccccc1)n1cc(c(NC(CSc2nccc(c3ccc(cc3)F)n2)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.6808 |
| logD: | 4.6344 |
| logSw: | -4.9968 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.491 |
| InChI Key: | XHOHXFOBOCMJIW-UHFFFAOYSA-N |