2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 3-ethoxybenzoate
Chemical Structure Depiction of
2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 3-ethoxybenzoate
2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 3-ethoxybenzoate
Compound characteristics
| Compound ID: | D037-0062 |
| Compound Name: | 2-oxo-7-phenyl-2H-1,3-benzoxathiol-5-yl 3-ethoxybenzoate |
| Molecular Weight: | 392.43 |
| Molecular Formula: | C22 H16 O5 S |
| Smiles: | CCOc1cccc(c1)C(=O)Oc1cc(c2ccccc2)c2c(c1)SC(=O)O2 |
| Stereo: | ACHIRAL |
| logP: | 5.1496 |
| logD: | 5.1496 |
| logSw: | -5.0961 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 49.225 |
| InChI Key: | JOEQOOPHGGYMQZ-UHFFFAOYSA-N |