3-benzyl-5-[(3-iodo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Chemical Structure Depiction of
3-benzyl-5-[(3-iodo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
3-benzyl-5-[(3-iodo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one
Compound characteristics
| Compound ID: | 3241-1029 |
| Compound Name: | 3-benzyl-5-[(3-iodo-5-methoxy-4-{2-[2-(prop-2-en-1-yl)phenoxy]ethoxy}phenyl)methylidene]-2-sulfanylidene-1,3-thiazolidin-4-one |
| Molecular Weight: | 643.56 |
| Molecular Formula: | C29 H26 I N O4 S2 |
| Smiles: | COc1cc(/C=C2/C(N(Cc3ccccc3)C(=S)S2)=O)cc(c1OCCOc1ccccc1CC=C)I |
| Stereo: | ACHIRAL |
| logP: | 7.5208 |
| logD: | 7.5208 |
| logSw: | -5.6204 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 38.897 |
| InChI Key: | XQMWEDJEIJMOHK-UHFFFAOYSA-N |