3-(2-phenylethyl)-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-(2-phenylethyl)-N-[2-(piperidin-1-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(2-phenylethyl)-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: | V006-1231 |
| Compound Name: | 3-(2-phenylethyl)-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: | 514.63 |
| Molecular Formula: | C29 H37 F3 N4 O |
| Salt: | not_available |
| Smiles: | C1CCN(CC1)CCNC(C1Cc2cc(ccc2N2CCN(CCc3ccccc3)CC12)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5198 |
| logD: | 2.7119 |
| logSw: | -4.2383 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.299 |
| InChI Key: | MSLQZAASJKLDBH-UHFFFAOYSA-N |