2-amino-7,7-dimethyl-1-(morpholin-4-yl)-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Chemical Structure Depiction of
2-amino-7,7-dimethyl-1-(morpholin-4-yl)-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
2-amino-7,7-dimethyl-1-(morpholin-4-yl)-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Compound characteristics
| Compound ID: | 4404-0249 |
| Compound Name: | 2-amino-7,7-dimethyl-1-(morpholin-4-yl)-5-oxo-4-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile |
| Molecular Weight: | 446.47 |
| Molecular Formula: | C23 H25 F3 N4 O2 |
| Smiles: | CC1(C)CC2=C(C(C(C#N)=C(N)N2N2CCOCC2)c2ccccc2C(F)(F)F)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0834 |
| logD: | 3.0834 |
| logSw: | -3.5092 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.93 |
| InChI Key: | CLCUZJGBSWHVIY-LJQANCHMSA-N |