2-[5-(morpholine-4-carbonyl)-8-nitro-1,2,4,4a,5,6-hexahydro-3H-pyrazino[1,2-a]quinolin-3-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Chemical Structure Depiction of
2-[5-(morpholine-4-carbonyl)-8-nitro-1,2,4,4a,5,6-hexahydro-3H-pyrazino[1,2-a]quinolin-3-yl]-1-(pyrrolidin-1-yl)ethan-1-one
2-[5-(morpholine-4-carbonyl)-8-nitro-1,2,4,4a,5,6-hexahydro-3H-pyrazino[1,2-a]quinolin-3-yl]-1-(pyrrolidin-1-yl)ethan-1-one
Compound characteristics
| Compound ID: | V002-0354 |
| Compound Name: | 2-[5-(morpholine-4-carbonyl)-8-nitro-1,2,4,4a,5,6-hexahydro-3H-pyrazino[1,2-a]quinolin-3-yl]-1-(pyrrolidin-1-yl)ethan-1-one |
| Molecular Weight: | 457.53 |
| Molecular Formula: | C23 H31 N5 O5 |
| Salt: | not_available |
| Smiles: | C1CCN(C1)C(CN1CCN2C(C1)C(Cc1cc(ccc12)[N+]([O-])=O)C(N1CCOCC1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.7963 |
| logD: | 0.1717 |
| logSw: | -2.1166 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 80.78 |
| InChI Key: | HBXGKLCOUCLBNI-UHFFFAOYSA-N |