3-(furan-2-carbonyl)-N-[2-(piperidin-1-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-(furan-2-carbonyl)-N-[2-(piperidin-1-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(furan-2-carbonyl)-N-[2-(piperidin-1-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V006-1301 |
| Compound Name: | 3-(furan-2-carbonyl)-N-[2-(piperidin-1-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 504.55 |
| Molecular Formula: | C26 H31 F3 N4 O3 |
| Salt: | not_available |
| Smiles: | C1CCN(CC1)CCNC(C1Cc2cc(ccc2N2CCN(CC12)C(c1ccco1)=O)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.1744 |
| logD: | 1.3665 |
| logSw: | -3.3596 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.815 |
| InChI Key: | GHSWTMLHFLHBQJ-UHFFFAOYSA-N |