1-{3-methyl-2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-sulfonyl}azepane
Chemical Structure Depiction of
1-{3-methyl-2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-sulfonyl}azepane
1-{3-methyl-2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-sulfonyl}azepane
Compound characteristics
| Compound ID: | F987-0283 |
| Compound Name: | 1-{3-methyl-2-[3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl]-1-benzofuran-5-sulfonyl}azepane |
| Molecular Weight: | 438.5 |
| Molecular Formula: | C22 H22 N4 O4 S |
| Smiles: | Cc1c2cc(ccc2oc1c1nc(c2cccnc2)no1)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3579 |
| logD: | 4.3027 |
| logSw: | -4.1163 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 81.73 |
| InChI Key: | JXCJCWWFHVSRDL-UHFFFAOYSA-N |