7-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 5-fluoro-3-methyl-1-benzofuran-2-carboxylate
Chemical Structure Depiction of
7-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 5-fluoro-3-methyl-1-benzofuran-2-carboxylate
7-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 5-fluoro-3-methyl-1-benzofuran-2-carboxylate
Compound characteristics
| Compound ID: | D037-0547 |
| Compound Name: | 7-(4-methoxyphenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 5-fluoro-3-methyl-1-benzofuran-2-carboxylate |
| Molecular Weight: | 450.44 |
| Molecular Formula: | C24 H15 F O6 S |
| Smiles: | Cc1c2cc(ccc2oc1C(=O)Oc1cc(c2ccc(cc2)OC)c2c(c1)SC(=O)O2)F |
| Stereo: | ACHIRAL |
| logP: | 6.0201 |
| logD: | 6.0201 |
| logSw: | -5.6925 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 58.171 |
| InChI Key: | MBGHEEVRURSSFK-UHFFFAOYSA-N |