Dipartimento di Farmacia, Università degli Studi di Parma, Parma, Italy.
Bioorg Med Chem Lett. 2012 Oct 15;22(20):6401-4. doi: 10.1016/j.bmcl.2012.08.067. Epub 2012 Aug 23.
We have synthesized and evaluated a series of 1,4-disubstituted-triazole derivatives for inhibition of the rat Na(V)1.6 sodium channel isoform, an isoform thought to play an important role in controlling neuronal firing. Starting from a series of 2,4(1H)-diarylimidazoles previously published, we decided to extend the SAR study by replacing the imidazole with a different heterocyclic scaffold and by varying the aryl substituents on the central aromatic ring. The 1,4-disubstituted 1,2,3-triazoles were prepared employing the copper-catalyzed azide-alkyne cycloaddition (CuAAC). Many of the new molecules were able to block the rNa(v)1.6 currents at 10 μM by over 20%, displaying IC(50) values ranging in the low micromolar, thus indicating that triazole can efficiently replace the central heterocyclic core. Moreover, the introduction of a long chain at C4 of the central triazole seems beneficial for increased rNa(v)1.6 current block, whereas the length of N1 substituent seems less crucial for inhibition, as long as a phenyl ring is not direcly connected to the triazole. These results provide additional information on the structural features necessary for block of the voltage-gated sodium channels. These new data will be exploited in the preparation of new compounds and could result in potentially useful AEDs.
我们合成并评估了一系列 1,4-取代的三唑衍生物,用于抑制大鼠 Na(V)1.6 钠通道同工型,该同工型被认为在控制神经元放电中起着重要作用。从之前发表的一系列 2,4(1H)-二芳基咪唑开始,我们决定通过用不同的杂环骨架取代咪唑并改变中心芳环上的芳基取代基来扩展 SAR 研究。1,4-取代的 1,2,3-三唑是通过铜催化的叠氮-炔环加成(CuAAC)制备的。许多新分子能够在 10 μM 时阻断 rNa(v)1.6 电流超过 20%,显示出 IC(50)值在低微摩尔范围内,这表明三唑可以有效地替代中心杂环核心。此外,在中心三唑的 C4 上引入长链似乎有利于增加 rNa(v)1.6 电流阻断,而 N1 取代基的长度对于抑制作用似乎不太关键,只要苯环不直接连接到三唑上。这些结果提供了有关电压门控钠离子通道阻断所需结构特征的更多信息。这些新数据将用于制备新化合物,并可能导致潜在有用的抗癫痫药物。