3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Chemical Structure Depiction of
3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}bicyclo[2.2.1]heptane-2-carboxylic acid
3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}bicyclo[2.2.1]heptane-2-carboxylic acid
Compound characteristics
| Compound ID: | Y205-5150 |
| Compound Name: | 3-{4-[3-(trifluoromethyl)phenyl]piperazine-1-carbonyl}bicyclo[2.2.1]heptane-2-carboxylic acid |
| Molecular Weight: | 396.41 |
| Molecular Formula: | C20 H23 F3 N2 O3 |
| Smiles: | C1CC2CC1C(C2C(N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O)C(O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.8691 |
| logD: | 0.2491 |
| logSw: | -3.1324 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.4 |
| InChI Key: | OBOLXMFGCWUCPO-UHFFFAOYSA-N |