2,5-dioxo-7-phenyl-1-[4-(trifluoromethoxy)phenyl]-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2,5-dioxo-7-phenyl-1-[4-(trifluoromethoxy)phenyl]-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
2,5-dioxo-7-phenyl-1-[4-(trifluoromethoxy)phenyl]-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | F454-0178 |
| Compound Name: | 2,5-dioxo-7-phenyl-1-[4-(trifluoromethoxy)phenyl]-1,2,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 424.38 |
| Molecular Formula: | C23 H15 F3 N2 O3 |
| Smiles: | C1C(CC(C2C=C(C#N)C(N(C1=2)c1ccc(cc1)OC(F)(F)F)=O)=O)c1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.5696 |
| logD: | 4.5696 |
| logSw: | -4.629 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.301 |
| InChI Key: | LOGLCFXVDMIWCT-HNNXBMFYSA-N |