3-(4-fluorophenyl)-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)-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)-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: | V018-3252 |
| Compound Name: | 3-(4-fluorophenyl)-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: | 465.59 |
| Molecular Formula: | C26 H28 F N3 O2 S |
| Salt: | not_available |
| Smiles: | COc1ccc2CC(C3CN(CCN3c2c1)c1ccc(cc1)F)C(NCCc1cccs1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.8947 |
| logD: | 4.8946 |
| logSw: | -4.5072 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 38.62 |
| InChI Key: | HDLXJXMXOMTMQA-UHFFFAOYSA-N |