3'-(benzenesulfonyl)-1-methyl-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'-(benzenesulfonyl)-1-methyl-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'-(benzenesulfonyl)-1-methyl-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: | 8018-2524 |
| Compound Name: | 3'-(benzenesulfonyl)-1-methyl-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: | 499.5 |
| Molecular Formula: | C22 H21 N5 O7 S |
| Smiles: | CN1C(C2(Cc3cc(ccc3N3CCN(CC23)S(c2ccccc2)(=O)=O)[N+]([O-])=O)C(NC1=O)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0117 |
| logD: | 1.9513 |
| logSw: | -2.892 |
| Hydrogen bond acceptors count: | 15 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 121.244 |
| InChI Key: | DKVLWVIIFPKOMX-UHFFFAOYSA-N |