6-bromo-3-(4-chlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Chemical Structure Depiction of
6-bromo-3-(4-chlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
6-bromo-3-(4-chlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-0135 |
| Compound Name: | 6-bromo-3-(4-chlorobenzene-1-sulfonyl)-2H-1-benzopyran-2-one |
| Molecular Weight: | 399.64 |
| Molecular Formula: | C15 H8 Br Cl O4 S |
| Smiles: | C1=C(C(=O)Oc2ccc(cc12)[Br])S(c1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1122 |
| logD: | 4.1122 |
| logSw: | -4.4803 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.661 |
| InChI Key: | RCYKVNVEHXUFBK-UHFFFAOYSA-N |