3-[(4-fluorophenyl)methyl]-N-[(furan-2-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)methyl]-N-[(furan-2-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V015-8319 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-N-[(furan-2-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 487.5 |
| Molecular Formula: | C26 H25 F4 N3 O2 |
| Smiles: | C1C(C2CN(CCN2c2ccc(cc12)C(F)(F)F)Cc1ccc(cc1)F)C(NCc1ccco1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5989 |
| logD: | 3.9924 |
| logSw: | -4.2437 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.246 |
| InChI Key: | OLEFIVVIZBOOFM-UHFFFAOYSA-N |