N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-{[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-{[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}acetamide
N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-{[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y502-6636 |
| Compound Name: | N-(1-benzyl-4-chloro-1H-pyrazol-3-yl)-2-{[4-(4-chlorophenyl)pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 470.38 |
| Molecular Formula: | C22 H17 Cl2 N5 O S |
| Smiles: | C(c1ccccc1)n1cc(c(NC(CSc2nccc(c3ccc(cc3)[Cl])n2)=O)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 5.2465 |
| logD: | 5.2001 |
| logSw: | -5.8084 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.491 |
| InChI Key: | JZLZZXGDTAIQGO-UHFFFAOYSA-N |