3-(2-phenoxyethyl)-N-[2-(pyridin-2-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-phenoxyethyl)-N-[2-(pyridin-2-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(2-phenoxyethyl)-N-[2-(pyridin-2-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V002-0825 |
| Compound Name: | 3-(2-phenoxyethyl)-N-[2-(pyridin-2-yl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 524.59 |
| Molecular Formula: | C29 H31 F3 N4 O2 |
| Salt: | not_available |
| Smiles: | C(CNC(C1Cc2cc(ccc2N2CCN(CCOc3ccccc3)CC12)C(F)(F)F)=O)c1ccccn1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3618 |
| logD: | 3.7208 |
| logSw: | -4.2561 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.278 |
| InChI Key: | BOEOAFQZTJGXQW-UHFFFAOYSA-N |