N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)acetamide
Chemical Structure Depiction of
N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)acetamide
N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)acetamide
Compound characteristics
| Compound ID: | 6807-0468 |
| Compound Name: | N-(2-oxo-2H-1,3-benzoxathiol-5-yl)-N-(2,4,5-trimethylbenzene-1-sulfonyl)acetamide |
| Molecular Weight: | 391.46 |
| Molecular Formula: | C18 H17 N O5 S2 |
| Smiles: | CC(N(c1ccc2c(c1)SC(=O)O2)S(c1cc(C)c(C)cc1C)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7254 |
| logD: | 3.7254 |
| logSw: | -4.0339 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 68.358 |
| InChI Key: | VRGQEUMLBDTTMD-UHFFFAOYSA-N |