4-hydroxy-2H-1-benzothiopyran-2-one
Chemical Structure Depiction of
4-hydroxy-2H-1-benzothiopyran-2-one
4-hydroxy-2H-1-benzothiopyran-2-one
Compound characteristics
| Compound ID: | 0157-0006 |
| Compound Name: | 4-hydroxy-2H-1-benzothiopyran-2-one |
| Molecular Weight: | 178.21 |
| Molecular Formula: | C9 H6 O2 S |
| Smiles: | C1=C(c2ccccc2SC1=O)O |
| Stereo: | ACHIRAL |
| logP: | 1.6975 |
| logD: | -0.4349 |
| logSw: | -2.2083 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 29.1777 |
| InChI Key: | XPSUDKVCLBDZFL-UHFFFAOYSA-N |