BChE inhibitor 8012-9656

• CAT Number: I047665
• CAS Number: 446266-84-8
• Molecular Formula: C21H17N7O2
• Molecular Weight: 399.41
• Purity: ≥95%
• IUPAC Name: 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)benzimidazol-1-yl]-N-(2-methylquinolin-6-yl)acetamide
• InChI: InChI=1S/C21H17N7O2/c1-12-6-7-13-10-14(8-9-15(13)23-12)24-18(29)11-28-17-5-3-2-4-16(17)25-21(28)19-20(22)27-30-26-19/h2-10H,11H2,1H3,(H2,22,27)(H,24,29)
• SMILES: CC1=NC2=C(C=C1)C=C(C=C2)NC(=O)CN3C4=CC=CC=C4N=C3C5=NON=C5N

BChE inhibitor 8012-9656 is a highly potent, selective and brain-penetrant inhibitor of butyrylcholinesterase with IC50 values of 0.18 and 0.32 μM for eqBChE and hBChE, respectively. BChE in a noncompetitive manner and could occupy the binding pocket forming diverse interactions with the target.
KEYWORDS: BChE inhibitor 8012-9656 | Supplier | BChE inhibitor | 8012 9656 | CAS [446266-84-8] | Choline-based esters | BChE | Inhibitor | Enzymes | Alzheimer’s disease

Reference

Q Li et al. Discovery and Biological Evaluation of a Novel Highly Potent Selective Butyrylcholinsterase Inhibitor. J Med Chem. 2020 Sep 10;63(17):10030-10044.