1-{3-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]benzene-1-sulfonyl}azepane
Chemical Structure Depiction of
1-{3-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]benzene-1-sulfonyl}azepane
1-{3-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]benzene-1-sulfonyl}azepane
Compound characteristics
| Compound ID: | J057-0609 |
| Compound Name: | 1-{3-[5-(3,4-dimethoxyphenyl)-1,3,4-oxadiazol-2-yl]benzene-1-sulfonyl}azepane |
| Molecular Weight: | 443.52 |
| Molecular Formula: | C22 H25 N3 O5 S |
| Smiles: | COc1ccc(cc1OC)c1nnc(c2cccc(c2)S(N2CCCCCC2)(=O)=O)o1 |
| Stereo: | ACHIRAL |
| logP: | 3.6005 |
| logD: | 3.6005 |
| logSw: | -3.7804 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.785 |
| InChI Key: | SGEWRANPVPWVNE-UHFFFAOYSA-N |