2-{[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-benzothiophen-3(2H)-one
Chemical Structure Depiction of
2-{[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-benzothiophen-3(2H)-one
2-{[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-benzothiophen-3(2H)-one
Compound characteristics
| Compound ID: | 3794-0226 |
| Compound Name: | 2-{[3-ethoxy-4-hydroxy-5-(prop-2-en-1-yl)phenyl]methylidene}-1-benzothiophen-3(2H)-one |
| Molecular Weight: | 338.42 |
| Molecular Formula: | C20 H18 O3 S |
| Smiles: | CCOc1cc(/C=C2/C(c3ccccc3S2)=O)cc(CC=C)c1O |
| Stereo: | ACHIRAL |
| logP: | 5.0934 |
| logD: | 5.0929 |
| logSw: | -4.7166 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.089 |
| InChI Key: | FGCYSXWPYSMLLW-UHFFFAOYSA-N |