N-(3-methoxypropyl)-3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-(3-methoxypropyl)-3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-(3-methoxypropyl)-3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V017-8212 |
| Compound Name: | N-(3-methoxypropyl)-3-(2-phenoxyethyl)-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 491.55 |
| Molecular Formula: | C26 H32 F3 N3 O3 |
| Salt: | not_available |
| Smiles: | COCCCNC(C1Cc2cc(ccc2N2CCN(CCOc3ccccc3)CC12)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0285 |
| logD: | 3.3875 |
| logSw: | -4.0535 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 46.348 |
| InChI Key: | SOZJCASWIUHEIB-UHFFFAOYSA-N |