1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)butan-1-one
Chemical Structure Depiction of
1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)butan-1-one
1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)butan-1-one
Compound characteristics
| Compound ID: | 8018-4828 |
| Compound Name: | 1-[4-(benzenesulfonyl)piperazin-1-yl]-3-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)butan-1-one |
| Molecular Weight: | 424.95 |
| Molecular Formula: | C19 H25 Cl N4 O3 S |
| Smiles: | CC(CC(N1CCN(CC1)S(c1ccccc1)(=O)=O)=O)n1c(C)c(c(C)n1)[Cl] |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.8989 |
| logD: | 1.8989 |
| logSw: | -3.0237 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.484 |
| InChI Key: | YFHRQXKZTYXGCV-AWEZNQCLSA-N |