7-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 4-[(prop-2-en-1-yl)oxy]benzoate
Chemical Structure Depiction of
7-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 4-[(prop-2-en-1-yl)oxy]benzoate
7-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 4-[(prop-2-en-1-yl)oxy]benzoate
Compound characteristics
| Compound ID: | D037-0178 |
| Compound Name: | 7-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 4-[(prop-2-en-1-yl)oxy]benzoate |
| Molecular Weight: | 434.47 |
| Molecular Formula: | C24 H18 O6 S |
| Smiles: | COc1ccc(cc1)c1cc(cc2c1OC(=O)S2)OC(c1ccc(cc1)OCC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4408 |
| logD: | 5.4408 |
| logSw: | -5.5439 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 57.063 |
| InChI Key: | BMGIIAJHHAHCHM-UHFFFAOYSA-N |