4,4-dimethyl-2-sulfanylidene-4'-(thiophen-2-yl)-3',4'-dihydrospiro[[1,3]diazinane-5,2'-pyrano[2,3-a]oxanthrene]-9',10'-dicarbonitrile
Chemical Structure Depiction of
4,4-dimethyl-2-sulfanylidene-4'-(thiophen-2-yl)-3',4'-dihydrospiro[[1,3]diazinane-5,2'-pyrano[2,3-a]oxanthrene]-9',10'-dicarbonitrile
4,4-dimethyl-2-sulfanylidene-4'-(thiophen-2-yl)-3',4'-dihydrospiro[[1,3]diazinane-5,2'-pyrano[2,3-a]oxanthrene]-9',10'-dicarbonitrile
Compound characteristics
| Compound ID: | 8014-7419 |
| Compound Name: | 4,4-dimethyl-2-sulfanylidene-4'-(thiophen-2-yl)-3',4'-dihydrospiro[[1,3]diazinane-5,2'-pyrano[2,3-a]oxanthrene]-9',10'-dicarbonitrile |
| Molecular Weight: | 500.6 |
| Molecular Formula: | C26 H20 N4 O3 S2 |
| Smiles: | CC1(C)C2(CC(c3ccc4c(c3O2)Oc2cc(C#N)c(C#N)cc2O4)c2cccs2)CNC(N1)=S |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.5317 |
| logD: | 5.5317 |
| logSw: | -5.6041 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.275 |
| InChI Key: | OUCPTLJGVQKBMP-UHFFFAOYSA-N |