N-(4-methoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(4-methoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
N-(4-methoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | 6807-0990 |
| Compound Name: | N-(4-methoxybenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide |
| Molecular Weight: | 447.53 |
| Molecular Formula: | C21 H21 N O6 S2 |
| Smiles: | COc1ccc(cc1)S(N(C(C1CCCCC1)=O)c1ccc2c(c1)SC(=O)O2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2719 |
| logD: | 4.2719 |
| logSw: | -4.4275 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 75.354 |
| InChI Key: | KTYKHEDVOMIQNG-UHFFFAOYSA-N |