1-{3,5-dimethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrazole-4-sulfonyl}-N-(4-fluorophenyl)piperidine-4-carboxamide
Chemical Structure Depiction of
1-{3,5-dimethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrazole-4-sulfonyl}-N-(4-fluorophenyl)piperidine-4-carboxamide
1-{3,5-dimethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrazole-4-sulfonyl}-N-(4-fluorophenyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | G935-0485 |
| Compound Name: | 1-{3,5-dimethyl-1-[2-oxo-2-(pyrrolidin-1-yl)ethyl]-1H-pyrazole-4-sulfonyl}-N-(4-fluorophenyl)piperidine-4-carboxamide |
| Molecular Weight: | 491.58 |
| Molecular Formula: | C23 H30 F N5 O4 S |
| Smiles: | Cc1c(c(C)n(CC(N2CCCC2)=O)n1)S(N1CCC(CC1)C(Nc1ccc(cc1)F)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9509 |
| logD: | 0.9503 |
| logSw: | -2.3843 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.081 |
| InChI Key: | XJUPAIHZFJVQGK-UHFFFAOYSA-N |