3-[(4-fluorophenyl)methyl]-9-methoxy-N-[2-(thiophen-2-yl)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-(thiophen-2-yl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-[(4-fluorophenyl)methyl]-9-methoxy-N-[2-(thiophen-2-yl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V003-7381 |
| Compound Name: | 3-[(4-fluorophenyl)methyl]-9-methoxy-N-[2-(thiophen-2-yl)ethyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 479.62 |
| Molecular Formula: | C27 H30 F N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1ccc2CC(C3CN(CCN3c2c1)Cc1ccc(cc1)F)C(NCCc1cccs1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.4249 |
| logD: | 3.8184 |
| logSw: | -4.1391 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.901 |
| InChI Key: | UBYONQYODIYKGW-UHFFFAOYSA-N |