methyl 4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1H-pyrrole-2-carboxylate
Chemical Structure Depiction of
methyl 4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1H-pyrrole-2-carboxylate
methyl 4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1H-pyrrole-2-carboxylate
Compound characteristics
| Compound ID: | E511-3953 |
| Compound Name: | methyl 4-{4-[3-(trifluoromethyl)phenyl]piperazine-1-sulfonyl}-1H-pyrrole-2-carboxylate |
| Molecular Weight: | 417.4 |
| Molecular Formula: | C17 H18 F3 N3 O4 S |
| Smiles: | COC(c1cc(c[nH]1)S(N1CCN(CC1)c1cccc(c1)C(F)(F)F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8027 |
| logD: | 2.8027 |
| logSw: | -3.5553 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.539 |
| InChI Key: | ZIPBZAFCTHXORD-UHFFFAOYSA-N |