N1-(吡啶-2-基)苯-1,4-二胺二盐酸盐 | 192217-97-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: N1-(吡啶-2-基)苯-1,4-二胺二盐酸盐
• 英文名称: N¹-(pyridin-2-yl)benzene-1,4-diamine
• 英文别名: N-pyridin-2-yl-benzene-1,4-diamine；N-pyridin-2-ylbenzene-1,4-diamine；4-N-pyridin-2-ylbenzene-1,4-diamine
• CAS: 192217-97-3；863221-45-8
• 化学式: C₁₁H₁₁N₃
• mdl: MFCD09931488
• 分子量: 185.228
• InChiKey: GIGDUYPRRWGWIC-UHFFFAOYSA-N

物化性质

• 沸点：
  360.8±17.0 °C(Predicted)
• 密度：
  1.226±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  14
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  50.9
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  N1-(吡啶-2-基)苯-1,4-二胺二盐酸盐 、 4-(tert-butyl)-benzoyl isothiocyanate 在 盐酸 作用下， 以 丙酮 、 乙醚 为溶剂， 反应 2.0h， 生成 4-tert-butyl-N-[[4-(pyridin-2-ylamino)phenyl]carbamothioyl]benzamide;hydrochloride
  参考文献：
  名称：

  SAR analysis of a series of acylthiourea derivatives possessing broad-spectrum antiviral activity

  摘要：

  A series of acylthiourea derivatives were designed, synthesized, and evaluated for broad-spectrum antiviral activity with selected viruses from Poxviridae (vaccinia virus) and two different genera of the family Bunyaviridae (Rift Valley fever and La Crosse viruses). A compound selected from a library screen, compound 1, displayed submicromolar antiviral activity against both vaccinia virus (EC50 = 0.25 mu M) and La Crosse virus (EC50 = 0.27 mu M) in cytopathic effect (CPE) assays. SAR analysis was performed to further improve antiviral potency and to optimize drug-like properties of the initial hits. During our analysis, we identified 26, which was found to be nearly fourfold more potent than 1 against both vaccinia and La Crosse viruses. Selected compounds were further tested to more fully characterize the spectrum of antiviral activity. Many of these possessed single digit micromolar and sub-micromolar antiviral activity against a diverse array of targets, including influenza virus (Orthomyxoviridae), Tacaribe virus (Arenaviridae), and dengue virus (Flaviviridae). (C) 2012 Elsevier Ltd. All rights

  DOI：

  10.1016/j.bmcl.2012.05.035
• 作为产物：
  描述：

  2-(4-硝基苯基氨基)吡啶 在 tin(ll) chloride 作用下， 以 乙酸乙酯 为溶剂， 以33%的产率得到N1-(吡啶-2-基)苯-1,4-二胺二盐酸盐
  参考文献：
  名称：

  WO2006/123145

  摘要：

  公开号：

文献信息

• NOVEL HETARYL-PHENYLENEDIAMINE-PYRIMIDINES AS PROTEIN KINASE INHIBITORS
  申请人：Jautelat Rolf

  公开号：US20080176866A1

  公开（公告）日：2008-07-24

  The invention relates to novel hetaryl-phenylenediamine-pyrimidines and to their structurally related oxygen and sulphur analogues of the general formula I, processes for their preparation, and their use as medicaments.

  这项发明涉及新型杂环-苯二胺-嘧啶化合物及其结构相关的氧和硫类似物，其一般化学式为I，以及它们的制备方法和作为药物的用途。
• One-pot propagation of (Hetero)Arylamines: Modular synthesis of diverse Amino-di(hetero)arylamines
  作者：Xueting Liang、Liang Xu、Cuihua Li、Xin Jia、Yu Wei

  DOI：10.1016/j.tet.2018.12.035

  日期：2019.2

  Formal propagation of (hetero)arylamine is achieved via a one-pot Buchwald–Hartwig C–N cross-coupling and nitro reduction sequence, enabling a rapid modular synthesis of diverse amino-di(hetero)arylamines from (hetero)arylamines and halogenated nitrobenzenes. Various functionalized aromatic amines with different electronic and steric environments can be efficiently prolongated to formally incorporate

  （杂）芳基胺的形式扩散是通过一锅Buchwald-Hartwig C-N交叉偶联和硝基还原序列实现的，从而可以从（杂）芳基胺和卤代硝基苯快速模块化合成各种氨基-二（杂）芳基胺。 。可以有效地延长具有不同电子和空间环境的各种官能化芳族胺，以正式引入另一种芳基氨基片段。该方法已成功地用于合成四十多种氨基二（杂）芳基胺。在寡聚苯胺和酪氨酸激酶抑制剂伊马替尼的合成中也证明了该方法的适用性。
• N-heteroaryl secondary para-phenylenediamine, a dye composition comprising such a para-phenylenediamine, a process for preparing this composition and use thereof
  申请人：Sabelle Stephane

  公开号：US20060005323A1

  公开（公告）日：2006-01-12

  The present disclosure relates to a novel family of N-heteroaryl secondary para-phenylenediamines, to their preparation, to their use for dyeing the hair and to a dye composition for dyeing keratin fibers, for example, human keratin fibers such as the hair, comprising, in a suitable dyeing medium, at least one heteroaryl secondary para-phenylenediamine. The disclosure also relates to the process using this composition, to its use and to the multi-compartment device and dyeing “kit”.

  本公开涉及一种新型的N-杂环芳基二次对苯二胺家族，其制备方法，以及用于染发的染料组合物和染色角蛋白纤维，例如人体角蛋白纤维，如头发，其中在适当的染料介质中包含至少一种杂环芳基二次对苯二胺。本公开还涉及使用该组合物的过程，其使用以及多室装置和染发“工具包”。
• Antifungal Agents
  申请人：Thomson Samantha Patricia

  公开号：US20080161302A1

  公开（公告）日：2008-07-03

  Compounds of formula (I), and pharmaceutically acceptable salts thereof, may be used in therapy, for example as antifungal agents: (I) wherein: R1, R2, R3, R4, R5, R6, R7, X and X 1 are as defined herein. Certain compounds of formula (I) are also provided. Compounds of formula (T), and agriculturally acceptable salts thereof, may also be used as agricultural fungicides.

  式(I)的化合物及其药学上可接受的盐可用于治疗，例如作为抗真菌剂：其中：R1、R2、R3、R4、R5、R6、R7、X和X1如此定义。还提供了式(I)的某些化合物。式(T)的化合物及其农业上可接受的盐也可用作农业杀菌剂。
• Antifungal agents
  申请人：Thomson Samantha Patricia

  公开号：US08486962B2

  公开（公告）日：2013-07-16

  Compounds of formula (I), and pharmaceutically acceptable salts thereof, may be used in therapy, for example as antifungal agents: (I) wherein: R1, R2, R3, R4, R5, R6, R7, X and X1 are as defined herein. Certain compounds of formula (I) are also provided. Compounds of formula (T), and agriculturally acceptable salts thereof, may also be used as agricultural fungicides.

  公式（I）的化合物及其药学上可接受的盐可以用于治疗，例如作为抗真菌剂：（I）其中：R1，R2，R3，R4，R5，R6，R7，X和X1如所定义。同时还提供了某些公式（I）的化合物。公式（T）的化合物及其农业上可接受的盐也可以用作农业杀菌剂。