N-[rel-(1R,4S)-bicyclo[2.2.1]heptan-2-yl]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
Chemical Structure Depiction of
N-[rel-(1R,4S)-bicyclo[2.2.1]heptan-2-yl]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
N-[rel-(1R,4S)-bicyclo[2.2.1]heptan-2-yl]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | V006-6695 |
| Compound Name: | N-[rel-(1R,4S)-bicyclo[2.2.1]heptan-2-yl]-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide |
| Molecular Weight: | 494.56 |
| Molecular Formula: | C28 H29 F3 N4 O |
| Salt: | not_available |
| Smiles: | [H][C@@]12CC[C@]([H])(C2)C(C1)NC(c1cc(nc2ccccc12)N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 7.0508 |
| logD: | 7.0508 |
| logSw: | -6.5443 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.927 |
| InChI Key: | QXUWVVDRSPOVGJ-VSVPBVKKSA-N |