2-{3,5-dimethyl-4-[3-(piperidine-1-carbonyl)piperidine-1-sulfonyl]-1H-pyrazol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{3,5-dimethyl-4-[3-(piperidine-1-carbonyl)piperidine-1-sulfonyl]-1H-pyrazol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
2-{3,5-dimethyl-4-[3-(piperidine-1-carbonyl)piperidine-1-sulfonyl]-1H-pyrazol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | G935-2776 |
| Compound Name: | 2-{3,5-dimethyl-4-[3-(piperidine-1-carbonyl)piperidine-1-sulfonyl]-1H-pyrazol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 465.61 |
| Molecular Formula: | C22 H35 N5 O4 S |
| Smiles: | Cc1c(c(C)n(CC(N2CCCC2)=O)n1)S(N1CCCC(C1)C(N1CCCCC1)=O)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.3861 |
| logD: | 0.3861 |
| logSw: | -1.4008 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 79.571 |
| InChI Key: | XDGSGDGSUAEEBU-IBGZPJMESA-N |