N-cyclopropyl-8-nitro-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-cyclopropyl-8-nitro-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-cyclopropyl-8-nitro-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V008-7119 |
| Compound Name: | N-cyclopropyl-8-nitro-3-phenyl-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 392.46 |
| Molecular Formula: | C22 H24 N4 O3 |
| Salt: | not_available |
| Smiles: | C1CC1NC(C1Cc2cc(ccc2N2CCN(CC12)c1ccccc1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.3807 |
| logD: | 3.3804 |
| logSw: | -3.6651 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.655 |
| InChI Key: | SRMRJLBXLHKMRU-UHFFFAOYSA-N |