N-(3-methoxypropyl)-8-nitro-3-(pyridin-2-yl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
N-(3-methoxypropyl)-8-nitro-3-(pyridin-2-yl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
N-(3-methoxypropyl)-8-nitro-3-(pyridin-2-yl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
Compound ID: | V014-4858 |
Compound Name: | N-(3-methoxypropyl)-8-nitro-3-(pyridin-2-yl)-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
Molecular Weight: | 425.49 |
Molecular Formula: | C22 H27 N5 O4 |
Salt: | not_available |
Smiles: | COCCCNC(C1Cc2cc(ccc2N2CCN(CC12)c1ccccn1)[N+]([O-])=O)=O |
Stereo: | MIXTURE OF STEREOISOMERS |
logP: | 2.5144 |
logD: | 2.514 |
logSw: | -2.9131 |
Hydrogen bond acceptors count: | 8 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 80.565 |
InChI Key: | CXXDUPBBQYZJTR-UHFFFAOYSA-N |