phenyl (4-bromobenzene-1-sulfonyl)(2-oxo-2H-1,3-benzoxathiol-5-yl)carbamate
Chemical Structure Depiction of
phenyl (4-bromobenzene-1-sulfonyl)(2-oxo-2H-1,3-benzoxathiol-5-yl)carbamate
phenyl (4-bromobenzene-1-sulfonyl)(2-oxo-2H-1,3-benzoxathiol-5-yl)carbamate
Compound characteristics
| Compound ID: | 6807-1054 |
| Compound Name: | phenyl (4-bromobenzene-1-sulfonyl)(2-oxo-2H-1,3-benzoxathiol-5-yl)carbamate |
| Molecular Weight: | 506.35 |
| Molecular Formula: | C20 H12 Br N O6 S2 |
| Smiles: | c1ccc(cc1)OC(N(c1ccc2c(c1)SC(=O)O2)S(c1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1147 |
| logD: | 5.1147 |
| logSw: | -5.4781 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 73.566 |
| InChI Key: | KAIFUIXBAPHGBN-UHFFFAOYSA-N |