ethyl 3-[3,5-dioxo-4-(2-phenylethyl)piperazine-1-sulfonyl]-1H-pyrazole-5-carboxylate
Chemical Structure Depiction of
ethyl 3-[3,5-dioxo-4-(2-phenylethyl)piperazine-1-sulfonyl]-1H-pyrazole-5-carboxylate
ethyl 3-[3,5-dioxo-4-(2-phenylethyl)piperazine-1-sulfonyl]-1H-pyrazole-5-carboxylate
Compound characteristics
| Compound ID: | G695-0097 |
| Compound Name: | ethyl 3-[3,5-dioxo-4-(2-phenylethyl)piperazine-1-sulfonyl]-1H-pyrazole-5-carboxylate |
| Molecular Weight: | 420.44 |
| Molecular Formula: | C18 H20 N4 O6 S |
| Smiles: | CCOC(c1cc(n[nH]1)S(N1CC(N(CCc2ccccc2)C(C1)=O)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.8488 |
| logD: | 0.8398 |
| logSw: | -2.4744 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 104.606 |
| InChI Key: | IQUZNAUGDJCYTE-UHFFFAOYSA-N |