3-(2-methoxyphenyl)-8-nitro-N-[(pyridin-4-yl)methyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-(2-methoxyphenyl)-8-nitro-N-[(pyridin-4-yl)methyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(2-methoxyphenyl)-8-nitro-N-[(pyridin-4-yl)methyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V008-8655 |
| Compound Name: | 3-(2-methoxyphenyl)-8-nitro-N-[(pyridin-4-yl)methyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C26 H27 N5 O4 |
| Salt: | not_available |
| Smiles: | COc1ccccc1N1CCN2C(C1)C(Cc1cc(ccc12)[N+]([O-])=O)C(NCc1ccncc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5552 |
| logD: | 2.5518 |
| logSw: | -2.8008 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 80.356 |
| InChI Key: | FGRSXPDLGHXXPK-UHFFFAOYSA-N |