2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl furan-2-carboxylate
Chemical Structure Depiction of
2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl furan-2-carboxylate
2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl furan-2-carboxylate
Compound characteristics
| Compound ID: | D037-0031 |
| Compound Name: | 2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl furan-2-carboxylate |
| Molecular Weight: | 338.34 |
| Molecular Formula: | C18 H10 O5 S |
| Smiles: | c1ccc(cc1)c1cc(cc2c1OC(=O)S2)OC(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9433 |
| logD: | 3.9433 |
| logSw: | -4.1497 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 50.68 |
| InChI Key: | APHSMRAPUNDCSE-UHFFFAOYSA-N |