methyl 4-({5-[5-(azepane-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2-methylbenzene-1-sulfonyl}amino)benzoate
Chemical Structure Depiction of
methyl 4-({5-[5-(azepane-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2-methylbenzene-1-sulfonyl}amino)benzoate
methyl 4-({5-[5-(azepane-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2-methylbenzene-1-sulfonyl}amino)benzoate
Compound characteristics
| Compound ID: | L286-1791 |
| Compound Name: | methyl 4-({5-[5-(azepane-1-carbonyl)-1,2,4-oxadiazol-3-yl]-2-methylbenzene-1-sulfonyl}amino)benzoate |
| Molecular Weight: | 498.56 |
| Molecular Formula: | C24 H26 N4 O6 S |
| Smiles: | Cc1ccc(cc1S(Nc1ccc(cc1)C(=O)OC)(=O)=O)c1nc(C(N2CCCCCC2)=O)on1 |
| Stereo: | ACHIRAL |
| logP: | 4.7327 |
| logD: | 3.9111 |
| logSw: | -4.4926 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 110.718 |
| InChI Key: | OGUMJFIKPTZRTE-UHFFFAOYSA-N |