N-(3-chloro-4-fluorophenyl)-1-{3,5-dimethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrazole-4-sulfonyl}piperidine-3-carboxamide
Chemical Structure Depiction of
N-(3-chloro-4-fluorophenyl)-1-{3,5-dimethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrazole-4-sulfonyl}piperidine-3-carboxamide
N-(3-chloro-4-fluorophenyl)-1-{3,5-dimethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrazole-4-sulfonyl}piperidine-3-carboxamide
Compound characteristics
| Compound ID: | G935-2712 |
| Compound Name: | N-(3-chloro-4-fluorophenyl)-1-{3,5-dimethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrazole-4-sulfonyl}piperidine-3-carboxamide |
| Molecular Weight: | 526.03 |
| Molecular Formula: | C23 H29 Cl F N5 O4 S |
| Smiles: | Cc1c(c(C)n(CC(N2CCCC2)=O)n1)S(N1CCCC(C1)C(Nc1ccc(c(c1)[Cl])F)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.5683 |
| logD: | 1.4166 |
| logSw: | -2.9466 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.014 |
| InChI Key: | QSQBFIVXWJIXMN-KRWDZBQOSA-N |