2,7,7-trimethyl-3-(piperidine-1-carbonyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinolin-5(1H)-one
Chemical Structure Depiction of
2,7,7-trimethyl-3-(piperidine-1-carbonyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinolin-5(1H)-one
2,7,7-trimethyl-3-(piperidine-1-carbonyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinolin-5(1H)-one
Compound characteristics
| Compound ID: | K836-0797 |
| Compound Name: | 2,7,7-trimethyl-3-(piperidine-1-carbonyl)-4-[4-(trifluoromethyl)phenyl]-4,6,7,8-tetrahydroquinolin-5(1H)-one |
| Molecular Weight: | 446.51 |
| Molecular Formula: | C25 H29 F3 N2 O2 |
| Smiles: | CC1=C(C(C2=C(CC(C)(C)CC2=O)N1)c1ccc(cc1)C(F)(F)F)C(N1CCCCC1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6578 |
| logD: | 1.1503 |
| logSw: | -4.3742 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.569 |
| InChI Key: | QELPQVZNPVKPDI-NRFANRHFSA-N |