3-(2-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-(2-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(2-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V009-2059 |
| Compound Name: | 3-(2-fluorophenyl)-N-[2-(4-methoxyphenyl)ethyl]-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 527.56 |
| Molecular Formula: | C29 H29 F4 N3 O2 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCNC(C2Cc3cc(ccc3N3CCN(CC23)c2ccccc2F)C(F)(F)F)=O)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.3007 |
| logD: | 5.3007 |
| logSw: | -5.1303 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.301 |
| InChI Key: | WUQULBAYHMIYFB-UHFFFAOYSA-N |