N-(4-fluorophenyl)-3-(pyridin-2-yl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-(4-fluorophenyl)-3-(pyridin-2-yl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-(4-fluorophenyl)-3-(pyridin-2-yl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V001-9922 |
| Compound Name: | N-(4-fluorophenyl)-3-(pyridin-2-yl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 470.47 |
| Molecular Formula: | C25 H22 F4 N4 O |
| Salt: | not_available |
| Smiles: | C1C(C2CN(CCN2c2ccc(cc12)C(F)(F)F)c1ccccn1)C(Nc1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.1904 |
| logD: | 5.1863 |
| logSw: | -5.2816 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.406 |
| InChI Key: | KKBXREYJOJJZSJ-UHFFFAOYSA-N |