N-(4-chlorobenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(4-chlorobenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
N-(4-chlorobenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | 6807-0981 |
| Compound Name: | N-(4-chlorobenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide |
| Molecular Weight: | 451.95 |
| Molecular Formula: | C20 H18 Cl N O5 S2 |
| Smiles: | C1CCC(CC1)C(N(c1ccc2c(c1)SC(=O)O2)S(c1ccc(cc1)[Cl])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8842 |
| logD: | 4.8842 |
| logSw: | -5.0399 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.811 |
| InChI Key: | GTMHBKRSLSHPQJ-UHFFFAOYSA-N |