Enantiopure Benzofuran-2-carboxamides of 1-Aryltetrahydro-β-carbolines Are Potent Antimalarials In Vitro

التفاصيل البيبلوغرافية
العنوان: Enantiopure Benzofuran-2-carboxamides of 1-Aryltetrahydro-β-carbolines Are Potent Antimalarials In Vitro
المؤلفون: Hanan Almolhim, Sha Ding, Joshua H. Butler, Emily K. Bremers, Grant J. Butschek, Carla Slebodnick, Emilio F. Merino, Zaira Rizopoulos, Maxim Totrov, Maria B. Cassera, Paul R. Carlier
المصدر: ACS Med Chem Lett
بيانات النشر: American Chemical Society, 2022.
سنة النشر: 2022
مصطلحات موضوعية: Organic Chemistry, Drug Discovery, Biochemistry
الوصف: [Image: see text] The tetrahydro-β-carboline scaffold has proven fertile ground for the discovery of antimalarial agents (e.g., MMV008138 (1) and cipargamin (2)). Similarity searching of a publicly disclosed collection of antimalarial hits for molecules resembling 1 drew our attention to N2-acyl tetrahydro-β-carboline GNF-Pf-5009 ((±)-3b). Compound purchase, “analog by catalog”, and independent synthesis of hits indicated the benzofuran-2-yl amide portion was required for in vitro efficacy against P. falciparum. Preparation of pure enantiomers demonstrated the pharmacological superiority of (R)-3b. Synthesis and evaluation of D- and F-ring substitution variants and benzofuran isosteres indicated a clear structure–activity relationship. Ultimately (R)-3b was tested in Plasmodium berghei-infected mice; unfavorable physicochemical properties may be responsible for the lack of oral efficacy.
اللغة: English
URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8f298d38c7df9acee8c964b34bf98ce4
https://europepmc.org/articles/PMC8919387/
Rights: OPEN
رقم الانضمام: edsair.doi.dedup.....8f298d38c7df9acee8c964b34bf98ce4
قاعدة البيانات: OpenAIRE