5-(4-amino-phenyl)-2-pyridin-2-yl-2H-pyrazol-3-ylamine | 19541-69-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 5-(4-amino-phenyl)-2-pyridin-2-yl-2H-pyrazol-3-ylamine
• 英文别名: 5-(4-Aminophenyl)-2-pyridin-2-ylpyrazol-3-amine
• CAS: 19541-69-6
• 化学式: C₁₄H₁₃N₅
• 分子量: 251.291
• InChiKey: GJBKQBZVWUSATH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.8
• 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：
  82.8
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

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

  2-肼吡啶 在 palladium on activated charcoal 氢气 、 三乙胺 作用下， 以 乙醇 、 乙酸乙酯 为溶剂， 生成 5-(4-amino-phenyl)-2-pyridin-2-yl-2H-pyrazol-3-ylamine
  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