7-(4-fluorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 5-fluoro-3-methyl-1-benzofuran-2-carboxylate
Chemical Structure Depiction of
7-(4-fluorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 5-fluoro-3-methyl-1-benzofuran-2-carboxylate
7-(4-fluorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 5-fluoro-3-methyl-1-benzofuran-2-carboxylate
Compound characteristics
| Compound ID: | D037-0632 |
| Compound Name: | 7-(4-fluorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 5-fluoro-3-methyl-1-benzofuran-2-carboxylate |
| Molecular Weight: | 438.4 |
| Molecular Formula: | C23 H12 F2 O5 S |
| Smiles: | Cc1c2cc(ccc2oc1C(=O)Oc1cc(c2ccc(cc2)F)c2c(c1)SC(=O)O2)F |
| Stereo: | ACHIRAL |
| logP: | 6.0668 |
| logD: | 6.0668 |
| logSw: | -5.6775 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.627 |
| InChI Key: | RWMPVCPQIWCMIR-UHFFFAOYSA-N |