4-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
Chemical Structure Depiction of
4-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
4-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl (4-methylphenoxy)acetate
Compound characteristics
Compound ID: | 4340-2134 |
Compound Name: | 4-(4-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)Oc1ccc2c(c1c1ccc(cc1)OC)SC(=O)O2 |
Stereo: | ACHIRAL |
logP: | 4.5833 |
logD: | 4.5833 |
logSw: | -4.688 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 56.951 |
InChI Key: | VJUUIPXZJUEHGU-UHFFFAOYSA-N |