3-[(4-methoxybenzene-1-sulfonyl)acetyl]-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[(4-methoxybenzene-1-sulfonyl)acetyl]-2H-1-benzopyran-2-one
3-[(4-methoxybenzene-1-sulfonyl)acetyl]-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | K222-0426 |
| Compound Name: | 3-[(4-methoxybenzene-1-sulfonyl)acetyl]-2H-1-benzopyran-2-one |
| Molecular Weight: | 358.37 |
| Molecular Formula: | C18 H14 O6 S |
| Smiles: | COc1ccc(cc1)S(CC(C1=Cc2ccccc2OC1=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1559 |
| logD: | 2.1559 |
| logSw: | -2.5226 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 70.715 |
| InChI Key: | LGXSXGLMOBHVRL-UHFFFAOYSA-N |