3-(4-chlorophenyl)-N-ethyl-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-ethyl-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-(4-chlorophenyl)-N-ethyl-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V008-8891 |
| Compound Name: | 3-(4-chlorophenyl)-N-ethyl-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 414.89 |
| Molecular Formula: | C21 H23 Cl N4 O3 |
| Salt: | not_available |
| Smiles: | CCNC(C1Cc2cc(ccc2N2CCN(CC12)c1ccc(cc1)[Cl])[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.828 |
| logD: | 3.8279 |
| logSw: | -4.437 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.496 |
| InChI Key: | FHUHIDGFALMWFJ-UHFFFAOYSA-N |