ethyl 3-(4-benzylpiperazine-1-sulfonyl)-1H-pyrazole-5-carboxylate
Chemical Structure Depiction of
ethyl 3-(4-benzylpiperazine-1-sulfonyl)-1H-pyrazole-5-carboxylate
ethyl 3-(4-benzylpiperazine-1-sulfonyl)-1H-pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | G695-0101 |
| Compound Name: | ethyl 3-(4-benzylpiperazine-1-sulfonyl)-1H-pyrazole-5-carboxylate |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C17 H22 N4 O4 S |
| Smiles: | CCOC(c1cc(n[nH]1)S(N1CCN(CC1)Cc1ccccc1)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8944 |
| logD: | 1.8768 |
| logSw: | -2.6748 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.78 |
| InChI Key: | JXKVWZZOPYEPDJ-UHFFFAOYSA-N |