5-(4-amino-phenyl)-2-phenyl-2H-pyrazol-3-ylamine | 13288-83-0

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 5-(4-amino-phenyl)-2-phenyl-2H-pyrazol-3-ylamine
• 英文别名: 5-(4-Amino-phenyl)-2-phenyl-2H-pyrazol-3-ylamin；5-Amino-1-phenyl-3-<4-amino-phenyl>-pyrazol；Pyrazole, 5-amino-3-(p-aminophenyl)-1-phenyl-；5-(4-aminophenyl)-2-phenylpyrazol-3-amine
• CAS: 13288-83-0
• 化学式: C₁₅H₁₄N₄
• 分子量: 250.303
• InChiKey: HZNCNTSMTYTUSA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  69.9
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  5-(4-amino-phenyl)-2-phenyl-2H-pyrazol-3-ylamine 、 对甲氧基苯磺酰氯 在 potassium carbonate 作用下， 以 四氢呋喃 为溶剂， 生成 N-[4-(5-Amino-1-phenyl-1H-pyrazol-3-yl)-phenyl]-4-methoxy-benzenesulfonamide
  参考文献：
  名称：

  Aminopyrazoles with high affinity for the human neuropeptide Y5 receptor

  摘要：

  1,3-Disubstituted-5-aminopyrazoles were prepared based on a lead compound found through high-throughput screening of our corporate compound library in an assay measuring affinity for the human neuropeptide Y5 receptor. The target compounds were prepared by cyclization of alpha -cyanoketones with appropriate hydrazines, followed by reduction and coupling to various sulfonamido-carboxylic acids. Several of these arylpyrazoles (e.g., 19 and 45) displayed high affinity for the human NPY Y5 receptor (< 20 nM IC(50)s). (C) 2001 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(01)00448-6
• 作为产物：
  描述：

  5-(4-硝基苯基)异噁唑-3-羧酸 在 锌 作用下， 生成 5-(4-amino-phenyl)-2-phenyl-2H-pyrazol-3-ylamine
  参考文献：
  名称：

  Cusmano, Gazzetta Chimica Italiana, 1939, vol. 69, p. 621,626,627

  摘要：

  DOI：

文献信息

• Methods and Compositions for the Treatment of RAS Associated Disorders
  申请人：Ratner Nancy

  公开号：US20120302581A1

  公开（公告）日：2012-11-29

  The instant disclosure relates to compositions that may be useful as therapeutic agents for the treatment of disorders associated or caused by Ras deregulation or dysregulation, for example, disorders associated with alterations in the NF1 gene such as neurofibromatosis type I, fungal infections such as those caused by Candida albicans , and proliferative disorders such as glioblastoma.