3-[(4-fluorophenyl)methyl]-9-methoxy-N-[2-(4-methoxyphenyl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-[(4-fluorophenyl)methyl]-9-methoxy-N-[2-(4-methoxyphenyl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-[(4-fluorophenyl)methyl]-9-methoxy-N-[2-(4-methoxyphenyl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V003-7405 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-9-methoxy-N-[2-(4-methoxyphenyl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 503.62 |
| Molecular Formula: | C30 H34 F N3 O3 |
| Salt: | not_available |
| Smiles: | COc1ccc(CCNC(C2Cc3ccc(cc3N3CCN(CC23)Cc2ccc(cc2)F)OC)=O)cc1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4482 |
| logD: | 3.8418 |
| logSw: | -4.1732 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.426 |
| InChI Key: | ZBCQQZFUUBIYLQ-UHFFFAOYSA-N |