6,8-dibromo-3-(4-chlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6,8-dibromo-3-(4-chlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
6,8-dibromo-3-(4-chlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-0138 |
| Compound Name: | 6,8-dibromo-3-(4-chlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C15 H7 Br2 Cl O4 S |
| Smiles: | C1=C(C(=O)Oc2c1cc(cc2[Br])[Br])S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1043 |
| logD: | 5.1043 |
| logSw: | -5.6043 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.345 |
| InChI Key: | XLQVKOAYDBKBJJ-UHFFFAOYSA-N |