3-benzyl-N-ethyl-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-benzyl-N-ethyl-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-benzyl-N-ethyl-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V030-3191 |
| Compound Name: | 3-benzyl-N-ethyl-8-(trifluoromethyl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 417.47 |
| Molecular Formula: | C23 H26 F3 N3 O |
| Salt: | not_available |
| Smiles: | CCNC(C1Cc2cc(ccc2N2CCN(CC12)Cc1ccccc1)C(F)(F)F)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.8188 |
| logD: | 2.8848 |
| logSw: | -3.9108 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.3942 |
| InChI Key: | PCQKJBXXDHGCIA-UHFFFAOYSA-N |