5-[(furan-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(furan-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(furan-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 0326-0526 |
| Compound Name: | 5-[(furan-2-yl)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 222.22 |
| Molecular Formula: | C9 H6 N2 O3 S |
| Smiles: | C(=C1C(NC(NC1=O)=S)=O)c1ccco1 |
| Stereo: | ACHIRAL |
| logP: | 1.115 |
| logD: | 0.6774 |
| logSw: | -1.9431 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.375 |
| InChI Key: | VQRARDATQWRHGF-UHFFFAOYSA-N |