3-[2-(morpholin-4-yl)-2-oxoethyl]-8-nitro-N-[(pyridin-3-yl)methyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Chemical Structure Depiction of
3-[2-(morpholin-4-yl)-2-oxoethyl]-8-nitro-N-[(pyridin-3-yl)methyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
3-[2-(morpholin-4-yl)-2-oxoethyl]-8-nitro-N-[(pyridin-3-yl)methyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide
Compound characteristics
| Compound ID: | V002-0896 |
| Compound Name: | 3-[2-(morpholin-4-yl)-2-oxoethyl]-8-nitro-N-[(pyridin-3-yl)methyl]-2,3,4,4a,5,6-hexahydro-1H-pyrazino[1,2-a]quinoline-5-carboxamide |
| Molecular Weight: | 494.55 |
| Molecular Formula: | C25 H30 N6 O5 |
| Smiles: | C1C(C2CN(CCN2c2ccc(cc12)[N+]([O-])=O)CC(N1CCOCC1)=O)C(NCc1cccnc1)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -0.0693 |
| logD: | -0.1214 |
| logSw: | -1.7263 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 97.697 |
| InChI Key: | BRFTUGJXUXEXSH-UHFFFAOYSA-N |