2-nitro-6-(trifluoromethoxy)aniline | 235101-48-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-nitro-6-(trifluoromethoxy)aniline
• 英文别名: 2-nitro-6-trifluoromethoxy-phenylamine
• CAS: 235101-48-1
• 化学式: C₇H₅F₃N₂O₃
• 分子量: 222.124
• InChiKey: PLBYWLQBIKTTNZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  81.1
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  2-nitro-6-(trifluoromethoxy)aniline 在 氮气 、 钯 、 氢气 、 乙醇 、 乙酸乙酯 、 3-(trifluoromethoxy)benzene-1,2-diamine 作用下， 以 乙醇 为溶剂， 反应 5.0h， 生成 3-(trifluoromethoxy)benzene-1,2-diamine
  参考文献：
  名称：

  BRIDGED SIX-MEMBERED RING COMPOUNDS

  摘要：

  本发明涉及式(I)的化合物，其中R1、R2、R1a、R2a、R3、R4、A、B、X、W和n如描述中所定义，并且这些化合物的药学上可接受的盐。这些化合物可用作钙通道阻滞剂。

  公开号：

  US20100130545A1
• 作为产物：
  描述：

  间硝基三氟甲氧基苯 在 1,1,1-三甲基碘化肼 、 potassium tert-butylate 、 盐酸 、 水 作用下， 以 二甲基亚砜 、 水 为溶剂， 反应 4.0h， 生成 2-nitro-6-(trifluoromethoxy)aniline
  参考文献：
  名称：

  [EN] 2,4 DI (HETERO) -ARYLAMINO-PYRIMIDINE DERIVATIVES AS ZAP-70 AND/OR SYK INHIBITORS
  [FR] DERIVES DE 2,4-DI(HETERO)-ARYLAMINO-PYRIMIDINE COMME INHIBITEURS DES KINASES ZAP-70 ET/OU SYK

  摘要：

  公开了具有以下式（I）的嘧啶衍生物；其中R0、R1、R3至R9和Z具有如权利要求1所示的含义，具有ZAP-70和/或Syk抑制活性。

  公开号：

  WO2005026158A1

文献信息

• 2,4 Di (hetero) -arylamino-pyrimidine derivatives as ZAP-70 and/or syk inhibitors
  申请人：Baenteli Rolf

  公开号：US20060247262A1

  公开（公告）日：2006-11-02

  Disclosed are pyrimidine derivatives of formula wherein R 0 , R 1 , R 3 to R 9 , and Z have a signification as indicated in claim 1, which have interesting pharmaceutical properties.

  本发明揭示了一种嘧啶衍生物，其化学式为其中R0，R1，R3至R9和Z的含义如权利要求1所示，具有有趣的药物特性。
• BRIDGED SIX-MEMBERED RING COMPOUNDS
  申请人：Hilpert Kurt

  公开号：US20100130545A1

  公开（公告）日：2010-05-27

  The invention relates to compounds of formula (I), wherein R 1 , R 2 , R 1a , R 2a , R 3 , R 4 , A, B, X, W and n are as defined in the description, and pharmaceutically acceptable salts of such compounds. These compounds are useful as calcium channel blockers.

  本发明涉及式(I)的化合物，其中R1、R2、R1a、R2a、R3、R4、A、B、X、W和n如描述中所定义，并且这些化合物的药学上可接受的盐。这些化合物可用作钙通道阻滞剂。
• 2,4- Di(hetero)-arylamino-pyrimidine derivatives as ZAP-70 and/or SYK inhibitors
  申请人：Novartis AG

  公开号：US08283356B2

  公开（公告）日：2012-10-09

  Disclosed are pyrimidine derivatives of formula wherein R0, R1, R3 to R9, and Z have a signification as indicated in claim 1, which have interesting pharmaceutical properties.

  本发明涉及一种嘧啶衍生物，其化学式为R0，R1，R3到R9和Z如权利要求1所示，具有有趣的药理学性质。
• 2,4- Di(hetero)-arylamino-pyrimidine Derivatives as ZAP-70 and/or SYK inhibitors
  申请人：Baenteli Rolf

  公开号：US20100152182A1

  公开（公告）日：2010-06-17

  Disclosed are pyrimidine derivatives of formula wherein R 0 , R 1 , R 3 to R 9 , and Z have a signification as indicated in claim 1 , which have interesting pharmaceutical properties.

  本发明涉及一种嘧啶衍生物，其化学式如下：其中，R0、R1、R3至R9和Z的含义如权利要求1所示，具有有趣的药理特性。
• Riluzole Series. Synthesis and in Vivo “Antiglutamate” Activity of 6-Substituted-2-benzothiazolamines and 3-Substituted-2-imino-benzothiazolines
  作者：Patrick Jimonet、François Audiau、Michel Barreau、Jean-Charles Blanchard、Alain Boireau、Yvette Bour、Marie-Annick Coléno、Adam Doble、Gilles Doerflinger、Claudine Do Huu、Marie-Hélène Donat、Jean Marie Duchesne、Pierre Ganil、Claude Guérémy、Eliane Honoré,、Bernard Just、Roselyne Kerphirique、Sylvie Gontier、Philippe Hubert、Pierre M. Laduron、Joseph Le Blevec、Mireille Meunier、Jean-Marie Miquet、Conception Nemecek、Martine Pasquet、Odile Piot、Jeremy Pratt、Jean Rataud、Michel Reibaud、Jean-Marie Stutzmann、Serge Mignani

  DOI：10.1021/jm980202u

  日期：1999.7.1

  Two series of analogues of riluzole, a blocker of excitatory amino acid mediated neurotransmission, have been synthesized: monosubstituted 2-benzothiazolamines and 3-substituted derivatives. Of all the compounds prepared in the first series, only 2-benzothiazolamines bearing alkyl, polyfluoroalkyl, or polyfluoroalkoxy substituents in the 6-position showed potent anticonvulsant activity against administration of glutamic acid in rats. The most active compounds displaying in vivo "antiglutamate" activity were the 6-OCF3 (riluzole), 6-OCF2CF3, 6-CF3, and 6-CF2CF3 substituted derivatives with ED50 values between 2.5 and 3.2 mg/kg i.p. Among the second series of variously substituted benzothiazolines, compounds as active as riluzole or up to 3 times more potent were identified in two series: benzothiazolines bearing a beta-dialkylaminoethyl moiety and compounds with an alkylthioalkyl chain and their corresponding sulfoxides and sulfones. The most potent derivatives were 2-imino-3-(2-methylthio)- and 2-imino-3-(2-methylsulfinyl)-ethyl-6-trifluoromethoxybenzothiazlines (61 and 64, ED50 = 10 and 1.1 mg/kg i.p., respectively). In addition, intraperitoneal administration of some of the best benzothiazolines protected mice from mortality produced by hypobaric hypoxia.