3-cyclopentyl-N-[2-(dimethylamino)ethyl]-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-cyclopentyl-N-[2-(dimethylamino)ethyl]-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-cyclopentyl-N-[2-(dimethylamino)ethyl]-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V028-8586 |
| Compound Name: | 3-cyclopentyl-N-[2-(dimethylamino)ethyl]-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 415.54 |
| Molecular Formula: | C22 H33 N5 O3 |
| Salt: | not_available |
| Smiles: | CN(C)CCNC(C1Cc2cc(ccc2N2CCN(CC12)C1CCCC1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.1117 |
| logD: | -0.124 |
| logSw: | -2.9792 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.776 |
| InChI Key: | PNZJPEYUGYZNND-UHFFFAOYSA-N |