phenyl (2,5-dimethylbenzene-1-sulfonyl)(2-oxo-2H-1,3-benzoxathiol-5-yl)carbamate
Chemical Structure Depiction of
phenyl (2,5-dimethylbenzene-1-sulfonyl)(2-oxo-2H-1,3-benzoxathiol-5-yl)carbamate
phenyl (2,5-dimethylbenzene-1-sulfonyl)(2-oxo-2H-1,3-benzoxathiol-5-yl)carbamate
Compound characteristics
| Compound ID: | 6807-1059 |
| Compound Name: | phenyl (2,5-dimethylbenzene-1-sulfonyl)(2-oxo-2H-1,3-benzoxathiol-5-yl)carbamate |
| Molecular Weight: | 455.51 |
| Molecular Formula: | C22 H17 N O6 S2 |
| Smiles: | Cc1ccc(C)c(c1)S(N(C(=O)Oc1ccccc1)c1ccc2c(c1)SC(=O)O2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0671 |
| logD: | 5.0671 |
| logSw: | -4.7297 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 73.566 |
| InChI Key: | OJXRSJDPVWHAOR-UHFFFAOYSA-N |