3-(2-chlorophenyl)-N-(4-fluorophenyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-(2-chlorophenyl)-N-(4-fluorophenyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(2-chlorophenyl)-N-(4-fluorophenyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V031-0300 |
| Compound Name: | 3-(2-chlorophenyl)-N-(4-fluorophenyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 503.93 |
| Molecular Formula: | C26 H22 Cl F4 N3 O |
| Salt: | not_available |
| Smiles: | C1C(C2CN(CCN2c2ccc(cc12)C(F)(F)F)c1ccccc1[Cl])C(Nc1ccc(cc1)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 6.194 |
| logD: | 6.1902 |
| logSw: | -6.3153 |
| Hydrogen bond acceptors count: | 2 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 28.5937 |
| InChI Key: | ZWCIWCGWJFSVFG-UHFFFAOYSA-N |