N-{2-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-2-oxoethyl}benzenesulfonamide
Chemical Structure Depiction of
N-{2-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-2-oxoethyl}benzenesulfonamide
N-{2-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-2-oxoethyl}benzenesulfonamide
Compound characteristics
| Compound ID: | F897-0787 |
| Compound Name: | N-{2-[4-(1-ethyl-3,5-dimethyl-1H-pyrazole-4-sulfonyl)piperazin-1-yl]-2-oxoethyl}benzenesulfonamide |
| Molecular Weight: | 469.58 |
| Molecular Formula: | C19 H27 N5 O5 S2 |
| Smiles: | CCn1c(C)c(c(C)n1)S(N1CCN(CC1)C(CNS(c1ccccc1)(=O)=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.1259 |
| logD: | 0.1251 |
| logSw: | -2.4333 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.186 |
| InChI Key: | IIGNPZFEQQBWGK-UHFFFAOYSA-N |