PNU 282987, alpha7 nAChR agonist

Key facts

CAS number

123464-89-1

Purity

>99%

Form

Solid

form

Molecular weight

301.2 Da

Molecular formula

C₁₄H₁₈Cl₂N₂O

PubChem

11243536

Nature

Synthetic

Solubility

Soluble in water to 100 mM

Biochemical name

Benzamide, N-(3R)-1-azabicyclo(2.2.2)oct-3-yl-4-chloro-, hydrochloride (1:1)

Biological description

Selective α7nAChR agonist. Negligible activity at α1β1γδ and α3β4 receptors. High affinity for rat α7nACh receptors (K_i = 26 nM). Functional antagonist at 5-HT₃ receptors (IC₅₀ = 4541 nM).

Canonical smiles

C1CN2CCC1C(C2)NC(=O)C3=CC=C(C=C3)Cl.Cl

Isomeric smiles

C1CN2CCC1[C@H](C2)NC(=O)C3=CC=C(C=C3)Cl.Cl

InChi

InChI=1S/C14H17ClN2O.ClH/c15-12-3-1-11(2-4-12)14(18)16-13-9-17-7-5-10(13)6-8-17;/h1-4,10,13H,5-9H2,(H,16,18);1H/t13-;/m0./s1

InChiKey

HSEQUIRZHDYOIX-ZOWNYOTGSA-N

IUPAC Name

N-[(3R)-1-azabicyclo[2.2.2]octan-3-yl]-4-chlorobenzamide;hydrochloride