3-cyclopentyl-N-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-ethyl-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-cyclopentyl-N-ethyl-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V008-5794 |
| Compound Name: | 3-cyclopentyl-N-ethyl-8-nitro-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 372.47 |
| Molecular Formula: | C20 H28 N4 O3 |
| Salt: | not_available |
| Smiles: | CCNC(C1Cc2cc(ccc2N2CCN(CC12)C1CCCC1)[N+]([O-])=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.5355 |
| logD: | 0.2998 |
| logSw: | -2.9074 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.695 |
| InChI Key: | PLRDNPWFGBHDEC-UHFFFAOYSA-N |