7-(3-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
Chemical Structure Depiction of
7-(3-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
7-(3-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
Compound characteristics
| Compound ID: | D037-0761 |
| Compound Name: | 7-(3-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C23 H18 O6 S |
| Smiles: | Cc1ccc(cc1)OCC(=O)Oc1cc(c2cccc(c2)OC)c2c(c1)SC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 5.0545 |
| logD: | 5.0545 |
| logSw: | -4.7279 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 56.549 |
| InChI Key: | DMGWYOACBIIOTC-UHFFFAOYSA-N |