2-(4-methoxyphenyl)-2H,4H-3,1-benzoxathiin-4-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-2H,4H-3,1-benzoxathiin-4-one
2-(4-methoxyphenyl)-2H,4H-3,1-benzoxathiin-4-one
Compound characteristics
| Compound ID: | 8010-0313 |
| Compound Name: | 2-(4-methoxyphenyl)-2H,4H-3,1-benzoxathiin-4-one |
| Molecular Weight: | 272.32 |
| Molecular Formula: | C15 H12 O3 S |
| Smiles: | COc1ccc(cc1)C1OC(c2ccccc2S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4747 |
| logD: | 3.4747 |
| logSw: | -3.7357 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 29.809 |
| InChI Key: | LDNYSHVCLQQWTK-HNNXBMFYSA-N |