ethyl 4-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
ethyl 4-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-1,2,5-trimethyl-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | E966-1358 |
| Compound Name: | ethyl 4-[4-(4-acetylphenyl)piperazine-1-sulfonyl]-1,2,5-trimethyl-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 447.55 |
| Molecular Formula: | C22 H29 N3 O5 S |
| Smiles: | CCOC(c1c(c(C)n(C)c1C)S(N1CCN(CC1)c1ccc(cc1)C(C)=O)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.875 |
| logD: | 1.875 |
| logSw: | -2.4597 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.569 |
| InChI Key: | ZITVADLLJLTVCJ-UHFFFAOYSA-N |