N-{4-chloro-1-[(3-fluorophenyl)methyl]-1H-pyrazol-3-yl}-1-(methanesulfonyl)piperidine-4-carboxamide
Chemical Structure Depiction of
N-{4-chloro-1-[(3-fluorophenyl)methyl]-1H-pyrazol-3-yl}-1-(methanesulfonyl)piperidine-4-carboxamide
N-{4-chloro-1-[(3-fluorophenyl)methyl]-1H-pyrazol-3-yl}-1-(methanesulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | Y502-9291 |
| Compound Name: | N-{4-chloro-1-[(3-fluorophenyl)methyl]-1H-pyrazol-3-yl}-1-(methanesulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 414.88 |
| Molecular Formula: | C17 H20 Cl F N4 O3 S |
| Smiles: | CS(N1CCC(CC1)C(Nc1c(cn(Cc2cccc(c2)F)n1)[Cl])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7957 |
| logD: | 1.5828 |
| logSw: | -2.9705 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.726 |
| InChI Key: | XKSUHHJKUNOJHF-UHFFFAOYSA-N |