2-{4-[4-(4-ethylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-{4-[4-(4-ethylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
2-{4-[4-(4-ethylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | G935-0601 |
| Compound Name: | 2-{4-[4-(4-ethylpiperazine-1-carbonyl)piperidine-1-sulfonyl]-3,5-dimethyl-1H-pyrazol-1-yl}-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 494.66 |
| Molecular Formula: | C23 H38 N6 O4 S |
| Smiles: | CCN1CCN(CC1)C(C1CCN(CC1)S(c1c(C)nn(CC(N2CCCC2)=O)c1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | -0.3134 |
| logD: | -0.7528 |
| logSw: | -1.0875 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 83.175 |
| InChI Key: | PFCKCTOITYNOEQ-UHFFFAOYSA-N |