3'-benzoyl-1,3-dimethyl-8'-nitro-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrazino[1,2-a]quinoline]-2,4,6-trione
Chemical Structure Depiction of
3'-benzoyl-1,3-dimethyl-8'-nitro-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrazino[1,2-a]quinoline]-2,4,6-trione
3'-benzoyl-1,3-dimethyl-8'-nitro-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrazino[1,2-a]quinoline]-2,4,6-trione
Compound characteristics
| Compound ID: | 8016-9118 |
| Compound Name: | 3'-benzoyl-1,3-dimethyl-8'-nitro-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrazino[1,2-a]quinoline]-2,4,6-trione |
| Molecular Weight: | 477.48 |
| Molecular Formula: | C24 H23 N5 O6 |
| Smiles: | CN1C(C2(Cc3cc(ccc3N3CCN(CC23)C(c2ccccc2)=O)[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.3571 |
| logD: | 2.3571 |
| logSw: | -2.8423 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 97.268 |
| InChI Key: | AOPFJKCARHSUSV-LJQANCHMSA-N |