6-bromo-3-(4-methoxybenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-(4-methoxybenzene-1-sulfonyl)-2H-1-benzopyran-2-one
6-bromo-3-(4-methoxybenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-0020 |
| Compound Name: | 6-bromo-3-(4-methoxybenzene-1-sulfonyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 395.23 |
| Molecular Formula: | C16 H11 Br O5 S |
| Smiles: | COc1ccc(cc1)S(C1=Cc2cc(ccc2OC1=O)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4999 |
| logD: | 3.4999 |
| logSw: | -3.8062 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.205 |
| InChI Key: | XLPIWOPNHHLVLF-UHFFFAOYSA-N |