N-(2,5-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(2,5-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
N-(2,5-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
Compound characteristics
Compound ID: | 7202-3584 |
Compound Name: | N-(2,5-dimethoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide |
Molecular Weight: | 477.55 |
Molecular Formula: | C22 H23 N O7 S2 |
Smiles: | COc1ccc(c(c1)S(N(C(C1CCCCC1)=O)c1ccc2c(c1)SC(=O)O2)(=O)=O)OC |
Stereo: | ACHIRAL |
logP: | 4.1364 |
logD: | 4.1364 |
logSw: | -4.4052 |
Hydrogen bond acceptors count: | 12 |
Polar surface area: | 82.985 |
InChI Key: | CBSZLAFWFHROGE-UHFFFAOYSA-N |