Aryl-carboxamide-benzoxazole-cpd36
IC50 12.62 nM for AChE and IC50 25.45 nM for BChE
General
Type : Carboxamide, Benzoxazol, Morpholine
Chemical_Nomenclature : (2-(1 H-pyrrol-2-yl)benzo[d]oxazol-6-yl)(morpholino)methanone
Canonical SMILES : C1=C(C=C2C(=C1)N=C(O2)C3=CC=C[N]3)C(=O)N4CCOCC4
InChI : InChI=1S\/C16H15N3O3\/c20-16(19-6-8-21-9-7-19)11-3-4-12-14(10-11)22-15(18-12)13-2-1-5-17-13\/h1-5,10,17H,6-9H2
InChIKey : KZWYCXDMMBMVLQ-UHFFFAOYSA-N
Other name(s) : Compound 36
MW : 297.31
Formula : C16H16N3O3 || C16H15N3O3
CAS_number :
PubChem :
UniChem : KZWYCXDMMBMVLQ-UHFFFAOYSA-N
Target
Families : Aryl-carboxamide-benzoxazole-cpd36 ligand of proteins in family
BCHE
ACHE
Protein :
human-BCHE
human-ACHE
References (1)
| Title : Structure-based inhibition of acetylcholinesterase and butyrylcholinesterase with 2-Aryl-6-carboxamide benzoxazole derivatives: synthesis, enzymatic assay, and in silico studies - Kuzu_2024_Mol.Divers__ |
| Author(s) : Kuzu B , Alagoz MA , Demir Y , Gulcin I , Burmaoglu S , Algul O |
| Ref : Mol Divers , : , 2024 |
| PubMedID: 38554169 |