N-(4-methylbenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
Chemical Structure Depiction of
N-(4-methylbenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
N-(4-methylbenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide
Compound characteristics
| Compound ID: | 6791-0025 |
| Compound Name: | N-(4-methylbenzene-1-sulfonyl)-N-(2-oxo-2H-1,3-benzoxathiol-5-yl)cyclohexanecarboxamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C21 H21 N O5 S2 |
| Smiles: | Cc1ccc(cc1)S(N(C(C1CCCCC1)=O)c1ccc2c(c1)SC(=O)O2)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7129 |
| logD: | 4.7129 |
| logSw: | -4.5643 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 67.811 |
| InChI Key: | UEDXCTLALOHDEQ-UHFFFAOYSA-N |