Furanoazepinone-isobenzofurandione-cpd5n
compound 5n AChE IC50= 2.38 +/- 0.02 nM. ROS-scavenging capabilities
General
Type : Azepane
Chemical_Nomenclature : 6,6-dimethyl-9,14-dioxa-3-azatetracyclo[8.7.0.02,8.012,16]heptadec-2(8)-ene-4,13,15-trione
Canonical SMILES : C1C3C(CC2C1C(OC2=O)=O)OC4=C3NC(CC(C4)(C)C)=O
InChI : InChI=1S\/C16H19NO5\/c1-16(2)5-11-13(17-12(18)6-16)9-3-7-8(4-10(9)21-11)15(20)22-14(7)19\/h7-10H,3-6H2,1-2H3,(H,17,18)
InChIKey : GRTWZQKGWUBWQZ-UHFFFAOYSA-N
Other name(s) : Compound 5n
Target
Families : Furanoazepinone-isobenzofurandione-cpd5n ligand of proteins in family
ACHE
Protein :
human-ACHE
References (1)
| Title : Novel Assembling of Furano-Fused Azepinone Derivatives for Inhibition of Acetylcholinesterase Responsible for Alzheimer's Disease: Synthesis, Molecular Docking, DFT, In Vitro, and In Silico Studies - Bhardwaj_2025_ACS.Chem.Neurosci__ |
| Author(s) : Bhardwaj A , Jaiswal S , Bhardwaj K , Paliwal T , Bharadwaj S , Negi S , Kumar G , Jain S , Kishore D , Sharma S , Dwivedi J |
| Ref : ACS Chem Neurosci , : , 2025 |
| Abstract : |
| PubMedSearch : Bhardwaj_2025_ACS.Chem.Neurosci__ |
| PubMedID: 41329558 |