N-(3,3-dimethylbutan-2-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
Chemical Structure Depiction of
N-(3,3-dimethylbutan-2-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
N-(3,3-dimethylbutan-2-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide
Compound characteristics
| Compound ID: | V001-5947 |
| Compound Name: | N-(3,3-dimethylbutan-2-yl)-2-{4-[3-(trifluoromethyl)phenyl]piperazin-1-yl}quinoline-4-carboxamide |
| Molecular Weight: | 484.56 |
| Molecular Formula: | C27 H31 F3 N4 O |
| Salt: | not_available |
| Smiles: | CC(C(C)(C)C)NC(c1cc(nc2ccccc12)N1CCN(CC1)c1cccc(c1)C(F)(F)F)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 6.8723 |
| logD: | 6.8722 |
| logSw: | -5.9915 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.593 |
| InChI Key: | HUGUXMBIICIGIS-SFHVURJKSA-N |