5-[(3-iodo-4,5-dimethoxyphenyl)methylidene]-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(3-iodo-4,5-dimethoxyphenyl)methylidene]-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(3-iodo-4,5-dimethoxyphenyl)methylidene]-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 8008-8289 |
| Compound Name: | 5-[(3-iodo-4,5-dimethoxyphenyl)methylidene]-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 508.33 |
| Molecular Formula: | C20 H17 I N2 O4 S |
| Smiles: | Cc1ccc(cc1)N1C(C(=C\c2cc(c(c(c2)I)OC)OC)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0213 |
| logD: | 3.6462 |
| logSw: | -4.0981 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.576 |
| InChI Key: | FGFNHERSUAKGJE-UHFFFAOYSA-N |