3-(4-fluorophenyl)-N-[(pyridin-3-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-(4-fluorophenyl)-N-[(pyridin-3-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(4-fluorophenyl)-N-[(pyridin-3-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V003-7261 |
| Compound Name: | 3-(4-fluorophenyl)-N-[(pyridin-3-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 484.5 |
| Molecular Formula: | C26 H24 F4 N4 O |
| Salt: | not_available |
| Smiles: | C1C(C2CN(CCN2c2ccc(cc12)C(F)(F)F)c1ccc(cc1)F)C(NCc1cccnc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0903 |
| logD: | 4.0878 |
| logSw: | -4.0442 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.735 |
| InChI Key: | GZMRCAFOFWAGIR-UHFFFAOYSA-N |