CAS: 873225-46-8; (4-((4-(Benzo[b]Thiophen-2-yl)Pyrimidin-2-yl)Amino)Phenyl)(4-(Pyrrolidin-1-yl)Piperidin-1-yl)Methanone

该化合物是合成有机化合物,其结构复杂,包括管状环,阳利度和苯并基-丙酰胺基组,具有合成有机复合物特征;该复合物展示了异环氨的典型特性,包括由于其与各种生物目标相互作用的能力而可能从事的生物活动;其分子结构表明,它可能具有药理特性,因此对医药化学和药物开发感兴趣;多种功能组的存在允许多种相互作用,这可能导致在治疗环境中的应用;此外,该化合物的溶解性,稳定性和再活性受到其特定替代物和总体分子结构的影响;与许多合成化合物一样,安全和处理预防措施必不可少,其对于生物系统的影响需要通过药理学研究进行彻底调查.

结构式图片

物理性质

MSDS等安全信息

欧盟法规

C&L通报

上下游产品

b]thiophen-2-yl-pyrimidin-2-ylamino)-benzoyl chloride4-(4-benzo[b]thiophen-2-yl-pyrimidin-2-ylamino)-benzoyl chloride 4-(1-pyrrolidinyl)piperidine b]thiophen-2-yl-pyrimidin-2-ylamino)-benzoic acid4-(4-benzo[b]thiophen-2-yl-pyrimidin-2-ylamino)-benzoic acid b]thiophen-2-yl-pyrimidin-2-ylamino)-benzoic acid methyl ester4-(4-benzo[b]thiophen-2-yl-pyrimidin-2-ylamino)-benzoic acid methyl ester

合成工艺路线路线简述

  • 5004-07-9 + 873225-37-7 = 873225-46-8
    反应条件:1.1 Reagents: Triethylamine Solvents: Tetrahydrofuran
    标题:Design And Preparation Of 2-Benzamido-Pyrimidines As Inhibitors Of Ikk
    作者:Waelchli,Rudolf; Et Al
    参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2006 卷标:16(1) 页码:108-112]

    873225-34-4 = 873225-46-8
    反应条件:1.1 Reagents: Sodium Hydroxide Solvents: Water1.2 Reagents: Thionyl Chloride2.1 Reagents: Triethylamine Solvents: Tetrahydrofuran
    标题:Design And Preparation Of 2-Benzamido-Pyrimidines As Inhibitors Of Ikk
    作者:Waelchli,Rudolf; Et Al
    参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2006 卷标:16(1) 页码:108-112]

    619-45-4 + 124959-26-8 = 873225-46-8
    反应条件:1.1 200 °C2.1 Reagents: Sodium Hydroxide Solvents: Water2.2 Reagents: Thionyl Chloride3.1 Reagents: Triethylamine Solvents: Tetrahydrofuran
    标题:Design And Preparation Of 2-Benzamido-Pyrimidines As Inhibitors Of Ikk
    作者:Waelchli,Rudolf; Et Al
    参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2006 卷标:16(1) 页码:108-112]

    3934-20-1 + 98437-23-1 = 873225-46-8
    反应条件:1.1 Reagents: Sodium Bicarbonate Catalysts: Tetrakis(Triphenylphosphine)Palladium Solvents: 1,2-Dimethoxyethane,Water2.1 200 °C3.1 Reagents: Sodium Hydroxide Solvents: Water3.2 Reagents: Thionyl Chloride4.1 Reagents: Triethylamine Solvents: Tetrahydrofuran
    标题:Design And Preparation Of 2-Benzamido-Pyrimidines As Inhibitors Of Ikk
    作者:Waelchli,Rudolf; Et Al
    参考文献:Bioorganic & Medicinal Chemistry Letters 日期:2006 卷标:16(1) 页码:108-112
📜苯并噻吩-2-硼酸置于sodium Hydroxide,四(三苯基膦)钯,氯化亚砜,碳酸氢钠,三乙胺体系中,用 四氢呋喃,乙二醇二甲醚,水 作为反应溶剂,化学反应生成 Ikk-16,选择性ikk抑制剂
参考文献:设计和制备2-苯甲酰胺基嘧啶作为ikk抑制剂.
标题:设计和制备2-苯甲酰胺基嘧啶作为ikk抑制剂.
摘要:描述,合成,和生物学评估2-苯甲酰胺基嘧啶作为新型的ikk抑制剂.通过优化先导化合物3,化合物16和24被确定为ikk2的非常好抑制剂,Ic(50)值分别为40和25 Nm.在细胞因子释放的急性模型中,化合物16还显示出显着的体内活性.
DOI:10.1016/j.Bmcl.2005.09.035

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主要参考文献


1: Tandon M, Johnson J, Li Z, Xu S, Wipf P, Wang QJ. New pyrazolopyrimidine inhibitors of protein kinase d as potent anticancer agents for prostate cancer cells. PLoS One. 2013 Sep 23;8(9):e75601. doi: 10.1371/journal.pone.0075601.
2: Mehmood T, Maryam A, Zhang H, Li Y, Khan M, Ma T. Deoxyelephantopin induces apoptosis in HepG2 cells via oxidative stress, NF-κB inhibition and mitochondrial dysfunction. Biofactors. 2016 Sep 15. doi: 10.1002/biof.1324. [Epub ahead of print] doi: 10.1097/TA.0000000000000229. doi: 10.1242/dmm.012435.
5: Ansbro MR, Shukla S, Ambudkar SV, Yuspa SH, Li L. Screening compounds with a novel high-throughput ABCB1-mediated efflux assay identifies drugs with known therapeutic targets at risk for multidrug resistance interference. PLoS One. 2013 Apr 10;8(4):e60334. doi: 10.1371/journal.pone.0060334.

合成参考文献


参考文献:10.1124/mol.119.115964
摘要:Lee TD, Lee OW, Brimacombe KR, Chen L, Guha R, Lusvarghi S, Tebase BG, Klumpp-Thomas C, Robey RW, Ambudkar SV, Shen M, Gottesman MM, Hall MD. A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein. Molecular Pharmacology. 2019 Nov;96(5):629–40. doi: 10.1124/mol.119.115964.
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