3-phenyl-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-phenyl-N-[2-(piperidin-1-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-phenyl-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: | V013-9655 |
| Compound Name: | 3-phenyl-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: | 486.58 |
| Molecular Formula: | C27 H33 F3 N4 O |
| Smiles: | C1CCN(CC1)CCNC(C1Cc2cc(ccc2N2CCN(CC12)c1ccccc1)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.5867 |
| logD: | 2.7788 |
| logSw: | -4.2258 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 34.041 |
| InChI Key: | HSYZXMMCUSKGDN-UHFFFAOYSA-N |