3'-(1,3-benzothiazol-2-yl)-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'-(1,3-benzothiazol-2-yl)-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'-(1,3-benzothiazol-2-yl)-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: | 8018-4132 |
| Compound Name: | 3'-(1,3-benzothiazol-2-yl)-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: | 506.54 |
| Molecular Formula: | C24 H22 N6 O5 S |
| Smiles: | CN1C(C2(Cc3cc(ccc3N3CCN(CC23)c2nc3ccccc3s2)[N+]([O-])=O)C(N(C)C1=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.0858 |
| logD: | 4.0855 |
| logSw: | -4.2636 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 93.607 |
| InChI Key: | NWNMOVMMSXQJPR-IBGZPJMESA-N |