3-(4-methoxyphenyl)-N-[(oxolan-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-methoxyphenyl)-N-[(oxolan-2-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(4-methoxyphenyl)-N-[(oxolan-2-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V002-7304 |
| Compound Name: | 3-(4-methoxyphenyl)-N-[(oxolan-2-yl)methyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 489.54 |
| Molecular Formula: | C26 H30 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(cc1)N1CCN2C(C1)C(Cc1cc(ccc12)C(F)(F)F)C(NCC1CCCO1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1471 |
| logD: | 4.1448 |
| logSw: | -4.1741 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.415 |
| InChI Key: | NHKQAOAIELCKGW-UHFFFAOYSA-N |