3'-benzyl-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'-benzyl-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'-benzyl-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: | 8017-5541 |
| Compound Name: | 3'-benzyl-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: | 463.49 |
| Molecular Formula: | C24 H25 N5 O5 |
| Smiles: | CN1C(C2(Cc3cc(ccc3N3CCN(CC23)Cc2ccccc2)[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9557 |
| logD: | 1.257 |
| logSw: | -3.436 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.352 |
| InChI Key: | YPKAFVXLYXTZST-HXUWFJFHSA-N |