7-(4-methylphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methoxyphenoxy)acetate
Chemical Structure Depiction of
7-(4-methylphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methoxyphenoxy)acetate
7-(4-methylphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methoxyphenoxy)acetate
Compound characteristics
| Compound ID: | D037-0107 |
| Compound Name: | 7-(4-methylphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methoxyphenoxy)acetate |
| Molecular Weight: | 422.46 |
| Molecular Formula: | C23 H18 O6 S |
| Smiles: | Cc1ccc(cc1)c1cc(cc2c1OC(=O)S2)OC(COc1ccc(cc1)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0365 |
| logD: | 5.0365 |
| logSw: | -4.7099 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 56.549 |
| InChI Key: | GWQSSJUQHJYNDU-UHFFFAOYSA-N |