2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-1-benzothiophen-3(2H)-one
2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 1809-0124 |
| Compound Name: | 2-[(3-ethoxy-4-hydroxy-5-iodophenyl)methylidene]-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 424.25 |
| Molecular Formula: | C17 H13 I O3 S |
| Smiles: | CCOc1cc(/C=C2/C(c3ccccc3S2)=O)cc(c1O)I |
| Stereo: | ACHIRAL |
| logP: | 5.0481 |
| logD: | 5.0043 |
| logSw: | -4.4883 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.089 |
| InChI Key: | ALNMUJLEWQEVCM-UHFFFAOYSA-N |