1-methyl-8'-nitro-2-sulfanylidene-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrido[1,2-a]quinoline]-4,6-dione
Chemical Structure Depiction of
1-methyl-8'-nitro-2-sulfanylidene-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrido[1,2-a]quinoline]-4,6-dione
1-methyl-8'-nitro-2-sulfanylidene-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrido[1,2-a]quinoline]-4,6-dione
Compound characteristics
| Compound ID: | 8015-9131 |
| Compound Name: | 1-methyl-8'-nitro-2-sulfanylidene-2',3',4',4'a-tetrahydro-1'H,6'H-spiro[[1,3]diazinane-5,5'-pyrido[1,2-a]quinoline]-4,6-dione |
| Molecular Weight: | 374.42 |
| Molecular Formula: | C17 H18 N4 O4 S |
| Smiles: | CN1C(C2(Cc3cc(ccc3N3CCCCC23)[N+]([O-])=O)C(NC1=S)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0298 |
| logD: | 1.5732 |
| logSw: | -2.8302 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.63 |
| InChI Key: | WDROLQJGZOXBSS-UHFFFAOYSA-N |