N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(thiophen-2-yl)pyrimidin-2-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(thiophen-2-yl)pyrimidin-2-yl]sulfanyl}acetamide
N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(thiophen-2-yl)pyrimidin-2-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y502-6261 |
| Compound Name: | N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-2-{[4-(thiophen-2-yl)pyrimidin-2-yl]sulfanyl}acetamide |
| Molecular Weight: | 459.95 |
| Molecular Formula: | C20 H15 Cl F N5 O S2 |
| Smiles: | C(c1c(cccc1[Cl])F)n1ccc(NC(CSc2nccc(c3cccs3)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.3361 |
| logD: | 4.3354 |
| logSw: | -4.4779 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.544 |
| InChI Key: | ZKEKTTFLKWUEJZ-UHFFFAOYSA-N |