N-{4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-1-(4-fluorobenzene-1-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-{4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-1-(4-fluorobenzene-1-sulfonyl)piperidine-3-carboxamide
N-{4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-1-(4-fluorobenzene-1-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | Y502-7873 |
| Compound Name: | N-{4-bromo-1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-1-(4-fluorobenzene-1-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 573.84 |
| Molecular Formula: | C22 H20 Br Cl F2 N4 O3 S |
| Smiles: | C1CC(CN(C1)S(c1ccc(cc1)F)(=O)=O)C(Nc1c(cn(Cc2c(cccc2[Cl])F)n1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0014 |
| logD: | 3.8789 |
| logSw: | -4.3172 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.896 |
| InChI Key: | CKFHWULSJHKSHC-AWEZNQCLSA-N |