1-(3-methyl-2-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-1-benzofuran-5-sulfonyl)azepane
Chemical Structure Depiction of
1-(3-methyl-2-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-1-benzofuran-5-sulfonyl)azepane
1-(3-methyl-2-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-1-benzofuran-5-sulfonyl)azepane
Compound characteristics
| Compound ID: | F987-0287 |
| Compound Name: | 1-(3-methyl-2-{3-[4-(methylsulfanyl)phenyl]-1,2,4-oxadiazol-5-yl}-1-benzofuran-5-sulfonyl)azepane |
| Molecular Weight: | 483.61 |
| Molecular Formula: | C24 H25 N3 O4 S2 |
| Smiles: | Cc1c2cc(ccc2oc1c1nc(c2ccc(cc2)SC)no1)S(N1CCCCCC1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 6.5578 |
| logD: | 6.5578 |
| logSw: | -5.7672 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 72.212 |
| InChI Key: | NKODYJZXDRVEMD-UHFFFAOYSA-N |