ethyl 1-methyl-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
ethyl 1-methyl-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1H-pyrrole-2-carboxylate
ethyl 1-methyl-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E138-1314 |
| Compound Name: | ethyl 1-methyl-4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 445.46 |
| Molecular Formula: | C19 H22 F3 N3 O4 S |
| Smiles: | CCOC(c1cc(cn1C)S(N1CCN(CC1)c1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9014 |
| logD: | 2.9014 |
| logSw: | -3.2839 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.273 |
| InChI Key: | XAFZUDKQWONUBL-UHFFFAOYSA-N |