5-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Chemical Structure Depiction of
5-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
5-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione
Compound characteristics
| Compound ID: | 3288-0035 |
| Compound Name: | 5-[(4-ethoxy-3-iodo-5-methoxyphenyl)methylidene]-1-(3-ethoxyphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione |
| Molecular Weight: | 552.39 |
| Molecular Formula: | C22 H21 I N2 O5 S |
| Smiles: | CCOc1cccc(c1)N1C(C(=C/c2cc(c(c(c2)I)OCC)OC)\C(NC1=S)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5827 |
| logD: | 4.3571 |
| logSw: | -4.403 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.279 |
| InChI Key: | IVXPTCUQGHWBNL-UHFFFAOYSA-N |