3-(4-chlorophenyl)-N-[(furan-2-yl)methyl]-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-(4-chlorophenyl)-N-[(furan-2-yl)methyl]-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(4-chlorophenyl)-N-[(furan-2-yl)methyl]-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V004-7219 |
| Compound Name: | 3-(4-chlorophenyl)-N-[(furan-2-yl)methyl]-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 466.92 |
| Molecular Formula: | C24 H23 Cl N4 O4 |
| Salt: | not_available |
| Smiles: | C1C(C2CN(CCN2c2ccc(cc12)[N+]([O-])=O)c1ccc(cc1)[Cl])C(NCc1ccco1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.579 |
| logD: | 4.5789 |
| logSw: | -4.932 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.347 |
| InChI Key: | YLKSHSHKZZQHAL-UHFFFAOYSA-N |