3-(2-fluorophenyl)-N-(3-methoxyphenyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-(2-fluorophenyl)-N-(3-methoxyphenyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(2-fluorophenyl)-N-(3-methoxyphenyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V009-2035 |
| Compound Name: | 3-(2-fluorophenyl)-N-(3-methoxyphenyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 499.51 |
| Molecular Formula: | C27 H25 F4 N3 O2 |
| Salt: | not_available |
| Smiles: | COc1cccc(c1)NC(C1Cc2cc(ccc2N2CCN(CC12)c1ccccc1F)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.7352 |
| logD: | 5.7347 |
| logSw: | -5.2783 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.138 |
| InChI Key: | HWWPSUXJAFVFEJ-UHFFFAOYSA-N |