4-chloro-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)benzamide
Chemical Structure Depiction of
4-chloro-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)benzamide
4-chloro-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)benzamide
Compound characteristics
| Compound ID: | 6807-0403 |
| Compound Name: | 4-chloro-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)benzamide |
| Molecular Weight: | 487.98 |
| Molecular Formula: | C23 H18 Cl N O5 S2 |
| Smiles: | Cc1cc(C)c(cc1C)S(N(C(c1ccc(cc1)[Cl])=O)c1ccc2c(c1)SC(=O)O2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8434 |
| logD: | 5.8434 |
| logSw: | -6.128 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.618 |
| InChI Key: | CYQCXXCZADNYLA-UHFFFAOYSA-N |