1,4-dimethyl-2-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1H-pyrrole-3-carboxylic acid
Chemical Structure Depiction of
1,4-dimethyl-2-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1H-pyrrole-3-carboxylic acid
1,4-dimethyl-2-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1H-pyrrole-3-carboxylic acid
Compound characteristics
| Compound ID: | G955-0109 |
| Compound Name: | 1,4-dimethyl-2-(2-oxo-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)-1H-pyrrole-3-carboxylic acid |
| Molecular Weight: | 409.41 |
| Molecular Formula: | C20 H22 F3 N3 O3 |
| Smiles: | Cc1cn(C)c(CC(N2CCN(CC2)c2cccc(c2)C(F)(F)F)=O)c1C(O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.666 |
| logD: | 0.8668 |
| logSw: | -2.4005 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.595 |
| InChI Key: | DNJZDQCYZGVARZ-UHFFFAOYSA-N |