ethyl 4-[3-(4-methylphenyl)-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carbonyl]piperazine-1-carboxylate
Chemical Structure Depiction of
ethyl 4-[3-(4-methylphenyl)-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carbonyl]piperazine-1-carboxylate
ethyl 4-[3-(4-methylphenyl)-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carbonyl]piperazine-1-carboxylate
Compound characteristics
| Compound ID: | V014-5937 |
| Compound Name: | ethyl 4-[3-(4-methylphenyl)-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carbonyl]piperazine-1-carboxylate |
| Molecular Weight: | 507.59 |
| Molecular Formula: | C27 H33 N5 O5 |
| Salt: | not_available |
| Smiles: | CCOC(N1CCN(CC1)C(C1Cc2cc(ccc2N2CCN(CC12)c1ccc(C)cc1)[N+]([O-])=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.0517 |
| logD: | 4.0491 |
| logSw: | -4.2006 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 78.613 |
| InChI Key: | INYNHQXJWSOGMX-UHFFFAOYSA-N |