3-(4-bromobenzene-1-sulfonyl)-6,8-difluoro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-(4-bromobenzene-1-sulfonyl)-6,8-difluoro-2H-1-benzopyran-2-one
3-(4-bromobenzene-1-sulfonyl)-6,8-difluoro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | C566-0987 |
| Compound Name: | 3-(4-bromobenzene-1-sulfonyl)-6,8-difluoro-2H-1-benzopyran-2-one |
| Molecular Weight: | 401.18 |
| Molecular Formula: | C15 H7 Br F2 O4 S |
| Smiles: | C1=C(C(=O)Oc2c1cc(cc2F)F)S(c1ccc(cc1)[Br])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9914 |
| logD: | 3.9914 |
| logSw: | -4.267 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 50.345 |
| InChI Key: | ASSKUVNRUYLKRD-UHFFFAOYSA-N |