Pitofenone (hydrochloride)

Pitofenone is an antispasmodic agent and an inhibitor of acetylcholinesterase (AChE, Kis = 36 and 45 µM for bovine erythrocyte and electric eel enzyme, respectively). It inhibits acetylcholine-induced contractions of isolated guinea pig ileum when used at a concentration of 2.5 µM.Formal Name: 2-[4-[2-(1-piperidinyl)ethoxy]benzoyl]-benzoic acid, methyl ester, monohydrochloride. CAS Number: 1248-42-6. Molecular Formula: C22H25NO4 . HCl. Formula Weight: 403.9. Purity: >98%. Formulation: (Request formulation change), A crystalline solid. Solubility: DMF: 30 mg/ml, DMSO: 25 mg/ml, Ethanol: 30 mg/ml, Ethanol:PBS(pH 7.2) (1:5): 0.16 mg/ml. lambdamax: 279 nm. SMILES: O=C(C1=CC=CC=C1C(OC)=O)C(C=C2)=CC=C2OCCN3CCCCC3.Cl. InChi Code: InChI=1S/C22H25NO4.ClH/c1-26-22(25)20-8-4-3-7-19(20)21(24)17-9-11-18(12-10-17)27-16-15-23-13-5-2-6-14-23,/h3-4,7-12H,2,5-6,13-16H2,1H3,1H. InChi Key: ZRFIFDFEDPJBII-UHFFFAOYSA-N.