4-(4-chlorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
Chemical Structure Depiction of
4-(4-chlorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
4-(4-chlorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
Compound characteristics
| Compound ID: | Y070-0875 |
| Compound Name: | 4-(4-chlorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate |
| Molecular Weight: | 426.87 |
| Molecular Formula: | C22 H15 Cl O5 S |
| Smiles: | Cc1ccc(cc1)OCC(=O)Oc1ccc2c(c1c1ccc(cc1)[Cl])SC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 5.1956 |
| logD: | 5.1956 |
| logSw: | -5.9324 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 49.408 |
| InChI Key: | LHPMFYNSFUSMIL-UHFFFAOYSA-N |