2-[(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)amino]quinoline-4-carboxylic acid
Chemical Structure Depiction of
2-[(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)amino]quinoline-4-carboxylic acid
2-[(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)amino]quinoline-4-carboxylic acid
Compound characteristics
| Compound ID: | G809-0796 |
| Compound Name: | 2-[(2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}ethyl)amino]quinoline-4-carboxylic acid |
| Molecular Weight: | 444.46 |
| Molecular Formula: | C23 H23 F3 N4 O2 |
| Smiles: | C(CN1CCN(CC1)c1cccc(c1)C(F)(F)F)Nc1cc(C(O)=O)c2ccccc2n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5881 |
| logD: | 0.9392 |
| logSw: | -4.2016 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 54.863 |
| InChI Key: | NIDWFBQUDKRROV-UHFFFAOYSA-N |