CAS: 244767-67-7; 4-((4-(Mesitylamino)Pyrimidin-2-yl)Amino)Benzonitrile

该化合物是一种化学化合物,其结构复杂,包括一个火水环和一个苯硝酸盐味.该化合物具有多种芳香系统,有助于其作为协调化学中的悬浮和有机合成中的一个构件的潜力.三甲基苯基氨组的存在增强了其溶解性,并可能影响其电子特性,使之适合用于制药或材料科学.该化合物的分子结构表明,它可能展示出有趣的生物活动,有可能在各种生物化学路径中作为抑制剂或调节器.此外,其稳定性和再活动可能受到现有功能组的影响,这些功能组可能影响到其在不同环境中的相互作用.

结构式图片

欧盟法规

ECHA物质C&L通报

上下游产品

2,4,6-trimethylaniline 4-Aminobenzonitrile 4-(4-chloro-6-(mesitylamino)pyrimidin-2-ylamino)benzonitrile 4-(4,6-dichloropyrimidine-2-yl-amino)benzonitrile

合成工艺路线路线简述

    4-N[2(4,6-二氯吡啶基)]-氨基苯腈置于palladium On Activated Charcoal,氢气,N,N-二异丙基乙胺体系中,用 四氢呋喃 用作溶剂,化学反应生成达匹韦林
    参考文献:Optimization Of Diarylazines As Anti-Hiv Agents With Dramatically Enhanced Solubility
    标题:Optimization Of Diarylazines As Anti-Hiv Agents With Dramatically Enhanced Solubility
    摘要:Non-Nucleoside Inhibitors Of Hiv-1 Reverse Transcriptase Are Reported That Have Ca. 100-Fold Greater Solubility Than The Structurally Related Drugs Etravirine And Rilpivirine,While Retaining High Anti-Viral Activity. The Solubility Enhancements Come From Strategic Placement Of A Morpholinylalkoxy Substituent In The Entrance Channel Of The Nnrti Binding Site. Compound 4D Shows Low-Nanomolar Activity Similar To Etravirine Towards Wild-Type Hiv-1 And Key Viral Variants. (C) 2013 Elsevier Ltd. All Rights Reserved.
    Doi:10.1016/j.Bmcl.2013.06.091

    海关参考信息

    专利信息


    专利号:US-2022233673-A1
    优先权日:2019-06-04
    标 题:METHODS OF PRODUCING SHIGA TOXIN B-SUBUNIT (STxB) MONOMERS AND OLIGOMERS, AND USES THEREOF
    发明人:BILLET ANNE; SCHMIDT FRÉDÉRIC; JOHANNES LUDGER; SERVENT DENIS; MOURIER GILLES; TARTOUR ÉRIC; KAY MICHAEL; FULCHER JAMES M
    权利人:INST CURIE; CENTRE NAT RECH SCIENT; INST NAT SANTE RECH MED; COMMISSARIAT A LENERGIE ATOMIQUE ET AUX ENERGIES ALTERNATIVES CEA; APHP ASSIST PUBLIQUE HOPITAUX DE PARIS; UNIV PARIS; UNIV OF UTAH RESEARCH FOUDATION; UNIV UTAH RES FOUND
    摘要:A method of producing a monomer of a Shiga toxin B-subunit (STxB) protein or of a variant thereof by peptide chemical synthesis, as well as to a method of producing a pentamer of the STxB protein or of the variant thereof. The methods are particularly advantageous as they overcome major issues typically observed in peptide chemical synthesis, including solubility and purity issues.

    专利号:US-2007099915-A1
    优先权日:2005-10-07
    标题 :Inhibitors of the hiv integrase enzyme
    发明人:DRESS KLAUS R; JOHNSON TED W; PLEWE MICHAEL B; TANIS STEVEN P; ZHU HUICHUN
    权利人:PFIZER
    摘要:The present invention is directed to compounds of formula (I), n nand pharmaceutically acceptable salts and solvates thereof, their synthesis, and their use as modulators or inhibitors of the human immunodeficiency virus (“HIVâ€?) integrase enzyme.

    专利号:US-7468375-B2
    优先权日:2004-04-26
    标题:Inhibitors of the HIV integrase enzyme
    发明人:DRESS KLAUS RUPRECHT; HU QIYUE; JOHNSON TED WILLIAM; PLEWE MICHAEL BRUNO; TANIS STEVEN PAUL; WANG HAI; YANG ANLE; YIN CHUNFENG; ZHANG JUNHU
    权利人:PFIZER
    摘要:The present invention is directed to compounds of formula (I), and pharmaceutically acceptable salts and solvates thereof, their synthesis, and their use as modulators or inhibitors of the human immunodeficiency virus (“HIVâ€?) integrase enzyme.

    专利号:US-2009170846-A1
    优先权日:2005-10-03
    标题 :Inhibitors of the hiv integrase enzyme
    发明人:DRESS KLAUS RUPRECHT; PLEWE MICHAEL BRUNO; JOHNSON TED WILLIAM; TANIS STEVEN PAUL; TRAN KHANH TUAN
    权利人:PFIZER
    摘要:The present invention is directed to compounds of formula (I), and pharmaceutically acceptable salts and solvates thereof, their synthesis, and their use as modulators or inhibitors of the human immunodeficiency virus “HIVâ€? integrase enzyme. Formula (I).

    专利号:EP-1873155-A1
    优先权日:2004-04-26
    标题:Inhibitors of the HIV integrase enzyme
    发明人:DRESS KLAUS RUPRECHT; HU QIYUE; JOHNSON TED WILLIAM; PLEWE MICHAEL BRUNO; TANIS STEVEN PAUL; ZHU HUICHUN; ZHANG JUNHU
    权利人:PFIZER
    摘要:The present invention is directed to compounds of formula (I),n nand pharmaceutically acceptable salts and solvates thereof, their synthesis, and their use as modulators or inhibitors of the human immunodeficiency virus ('HIV') integrase enzyme.

    专利号:US-7405310-B2
    优先权日:2001-03-05
    标 题:Non-nucleoside reverse transcriptase inhibitors
    发明人:LINDSTROM STEFAN; SAHLBERG CHRISTER; WALLBERG HANS; KALYANOV GENAIDY; ODEN LOURDES SALVADOR; NAESLUND LOTTA
    权利人:MEDIVIR AB
    摘要:This invention relates to non-nucleoside reverse transcriptase inhibitors active against HIV-1 and having an improved resistance and pharmacokinetic profile. The invention further relates to novel intermediates in the synthesis of such compounds and the use of the compounds in antiviral methods and compositions.
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    主要参考文献


    1: Dezzutti CS, Yandura S, Wang L, Moncla B, Teeple EA, Devlin B, Nuttall J, Brown ER, Rohan LC. Pharmacodynamic Activity of Dapivirine and Maraviroc Single Entity and Combination Topical Gels for HIV-1 Prevention. Pharm Res. 2015 Nov;32(11):3768-81. doi: 10.1007/s11095-015-1738-7. Epub 2015 Jun 16. doi: 10.1371/journal.pone.0128857. eCollection 2015.
    3: Chen BA, Panther L, Marzinke MA, Hendrix CW, Hoesley CJ, van der Straten A, Husnik MJ, Soto-Torres L, Nel A, Johnson S, Richardson-Harman N, Rabe LK, Dezzutti CS. Phase 1 Safety, Pharmacokinetics, and Pharmacodynamics of Dapivirine and Maraviroc Vaginal Rings: a Double-Blind Randomized Trial. J Acquir Immune Defic Syndr. 2015 May 28. [Epub ahead of print] doi: 10.1016/j.actbio.2015.02.007. Epub 2015 Feb 17. doi: 10.1002/jps.24176. Epub 2014 Sep 17. doi: 10.1016/j.jpba.2014.06.018. Epub 2014 Jun 21.
    7: Nel A, Haazen W, Nuttall J, Romano J, Rosenberg Z, van Niekerk N. A safety and pharmacokinetic trial assessing delivery of dapivirine from a vaginal ring in healthy women. AIDS. 2014 Jun 19;28(10):1479-87. doi: 10.1097/QAD.0000000000000280. doi: 10.1093/jac/dku160. Epub 2014 May 26. doi: 10.1021/mp4007024. Epub 2014 Apr 14.

    合成参考文献


    参考文献:10.1016/s0960-894x(01)00412-7
    摘要:Ludovici DW, De Corte BL, Kukla MJ, Ye H, Ho CY, Lichtenstein MA, Kavash RW, Andries K, de Béthune M, Azijn H, Pauwels R, Lewi PJ, Heeres J, Koymans LMH, de Jonge MR, Van Aken KJA, Daeyaert FFD, Das K, Arnold E, Janssen PAJ. Evolution of anti-HIV drug candidates. Part 3: diarylpyrimidine (DAPY) analogues. Bioorganic & Medicinal Chemistry Letters. 2001 Sep;11(17):2235–9. doi: 10.1016/s0960-894x(01)00412-7.
    参考文献:10.1016/j.ejps.2012.12.002
    摘要:Fetherston SM, Boyd P, McCoy CF, McBride MC, Edwards K, Ampofo S, Malcolm RK. A silicone elastomer vaginal ring for HIV prevention containing two microbicides with different mechanisms of action. European Journal of Pharmaceutical Sciences. 2013 Feb;48(3):406–15. doi: 10.1016/j.ejps.2012.12.002.
    参考文献:10.1007/s40262-014-0148-z
    摘要:Trezza CR, Kashuba ADM. Pharmacokinetics of Antiretrovirals in Genital Secretions and Anatomic Sites of HIV Transmission: Implications for HIV Prevention. Clinical Pharmacokinetics. 2014 May 24;53(7):611–24. doi: 10.1007/s40262-014-0148-z.
    参考文献:10.1093/jac/dku160
    摘要:Murphy DJ, Desjardins D, Dereuddre-Bosquet N, Brochard P, Perrot L, Pruvost A, Le Grand R, Lagatie O, Vanhooren L, Feyaerts M, van Roey J, Malcolm RK. Pre-clinical development of a combination microbicide vaginal ring containing dapivirine and darunavir. J Antimicrob Chemother. 2014 Sep;69(9):2477–88. doi: 10.1093/jac/dku160.
    参考文献:10.1111/bcp.13625
    摘要:Kay K, Shah DK, Rohan L, Bies R. Physiologically-based pharmacokinetic model of vaginally administered dapivirine ring and film formulations. Br J Clin Pharmacol. 2018 Sep;84(9):1950–69.
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