4-(4-fluorophenyl)-2-methylpyrimidine | 85979-51-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: 4-(4-fluorophenyl)-2-methylpyrimidine
• CAS: 85979-51-7
• 化学式: C₁₁H₉FN₂
• 分子量: 188.204
• InChiKey: NWLUZGJNTVAQDO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  25.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-碘苯甲醚 、 4-(4-fluorophenyl)-2-methylpyrimidine 在 palladium diacetate 、 silver trifluoroacetate 、 丙酸 作用下， 反应 15.0h， 以36%的产率得到4-(5-fluoro-4'-methoxybiphenyl-2-yl)-2-methylpyrimidine
  参考文献：
  名称：

  Pyrimidine as an Aryl C–H Activating Group

  摘要：

  The Pd-catalyzed regioselective C-H activation/arylation, /iodination, and/acetoxylation reactions of 4-arylpyrimidines using aryl iodides, N-iodosuccinimide, and (diacetoxyiodo)benzene respectively as coupling partners are described. Suzuki-Miyaura coupling and Sonogashira reactions of the resulting aryl iodides are demonstrated. The scalability of the C-H activation/functionalization starting with readily accessible 4-aryl pyrimidines is also reported.

  DOI：

  10.1021/acs.orglett.8b01300
• 作为产物：
  描述：

  sodium;(E)-3-(4-fluorophenyl)-3-oxoprop-1-en-1-olate 、 乙脒碱 以43%的产率得到
  参考文献：
  名称：

  BARAM, S. G.;SHKURKO, O. P.;MAMAEV, V. P., IZV. CO AN CCCP. CEP. XIM. N., 1983, N 4/2, 111-117

  摘要：

  DOI：

文献信息

• [EN] NEW PYRIMIDINE LINKED PYRROLO[2,1-c][1,4]BENZODIAZEPINES AS POTENTIAL ANTITUMOUR AGENTS<br/>[FR] NOUVELLES PYRROLO[2,1-C][1,4]BENZODIAZEPINES A LIAISON PYRIMIDINE UTILISEES COMME AGENTS ANTITUMORAUX POTENTIELS
  申请人：COUNCIL SCIENT IND RES

  公开号：WO2004087712A1

  公开（公告）日：2004-10-14

  The present invention relates to a process for the preparation of novel pyrrolo [2,1­c][1,4]benzodiazepines useful as potential antitumour agents. This invention also relates to a process for the preparation of new pyrrolo[2,1-c][1,4]benzodiazepines as potential antitumour agents. More particularly, it provides a process for the preparation of 7-methoxy-8-[6'-(4'-fluorophenyl)-2'-methylpyrimidine-4'-yloxy] alkoxy-(l 1aS)-1,2,3,11 a-tetrahydro-5H­-pyrrolo[2,1,c][1,4]benzodiazepin-5-one with aliphatic chain length variations for the compounds and it also describes the anticancer (antitumour) activity. The structural formula (I) of novel pyrrolo[2,1-c] [ 1,4]benzodiazepine is as follows.

  本发明涉及一种制备新型吡咯并[2,1-c][1,4]苯二氮平类化合物的方法，该化合物可作为潜在的抗肿瘤剂。该发明还涉及一种制备新型吡咯并[2,1-c][1,4]苯二氮平类化合物的方法，该化合物也可作为潜在的抗肿瘤剂。更具体地说，本发明提供了一种制备7-甲氧基-8-[6'-(4'-氟苯基)-2'-甲基嘧啶-4'-氧基]烷氧基-(l 1aS)-1,2,3,11 a-四氢-5H-吡咯并[2,1,c][1,4]苯二氮平-5-酮的方法，该方法具有不同碳链长度的化合物，并且还描述了该化合物的抗癌（抗肿瘤）活性。新型吡咯并[2,1-c][1,4]苯二氮平类化合物的结构式（I）如下：
• PHENETHYLAMIDE DERIVATIVES AND THEIR HETEROCYCLIC ANALOGUES
  申请人：Aissaoui Hamed

  公开号：US20110212968A1

  公开（公告）日：2011-09-01

  The invention relates to novel phenethylamide derivatives and their wherein A, B, R 1 , R 2 and R 3 are as described in the application, and to the use of such compounds, or of pharmaceutically acceptable salts of such compounds, as medicaments, especially as orexin receptor antagonists.

  本发明涉及新型苯乙酰胺衍生物及其其中A、B、R1、R2和R3如本申请中所述的衍生物的药物学上可接受的盐的使用，特别是作为药物，尤其是作为促进睡眠的药物，如促进睡眠的药物。
• Synthesis of 4-Aryl and Unsymmetrical 4,6-Diarylpyrimidines by the Suzuki-Miyaura Cross-Coupling Reaction
  作者：Victor Snieckus、Gerald J. Tanoury、Sahaj Gupta、Jennifer A. Melanson、M Selim Hossain、Louis Vaillancourt、William A. Nugent

  DOI：10.3987/com-18-13956

  日期：——

  A two-step procedure for the synthesis of 4-arylpyrimidines from inexpensive 4,6-dichloropyrimidine via a Suzuki-Miyaura/hydrodechlorination reaction sequence is described. The reaction resulted in the predominant formation of mono-arylated product. The cross-coupling of 4-chloro-6-substituted pyrimidines with various aryl/heteroarylboronic acids also furnished 4,6-disubstituted pyrimidines in acceptable yields.