7-(2-chlorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 4-bromobenzoate
Chemical Structure Depiction of
7-(2-chlorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 4-bromobenzoate
7-(2-chlorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 4-bromobenzoate
Compound characteristics
| Compound ID: | 4264-0931 |
| Compound Name: | 7-(2-chlorophenyl)-2-oxo-2H-1,3-benzoxathiol-5-yl 4-bromobenzoate |
| Molecular Weight: | 461.72 |
| Molecular Formula: | C20 H10 Br Cl O4 S |
| Smiles: | c1ccc(c(c1)c1cc(cc2c1OC(=O)S2)OC(c1ccc(cc1)[Br])=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 6.2223 |
| logD: | 6.2223 |
| logSw: | -6.1335 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 42.101 |
| InChI Key: | OBXPOLPTGDQKAB-UHFFFAOYSA-N |