3'-benzyl-1-methyl-8'-nitro-3-propyl-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-methyl-8'-nitro-3-propyl-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-methyl-8'-nitro-3-propyl-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: | 8017-5483 |
| Compound Name: | 3'-benzyl-1-methyl-8'-nitro-3-propyl-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: | 491.55 |
| Molecular Formula: | C26 H29 N5 O5 |
| Smiles: | CCCN1C(C2(Cc3cc(ccc3N3CCN(CC23)Cc2ccccc2)[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.487 |
| logD: | 1.7883 |
| logSw: | -3.7845 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 84.565 |
| InChI Key: | GMYYKMJKKIUFBV-UHFFFAOYSA-N |