3,5-二氯-2-氟-6-(4-嘧啶-2-基-哌嗪-1-基)-吡啶-4-基胺 | 1027572-25-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪烷类
• 中文名称: 3,5-二氯-2-氟-6-(4-嘧啶-2-基-哌嗪-1-基)-吡啶-4-基胺
• 英文名称: 3,5-Dichloro-2-fluoro-6-(4-pyrimidin-2-yl-piperazin-1-yl)-pyridin-4-ylamine
• 英文别名: 3,5-Dichloro-2-fluoro-6-(4-pyrimidin-2-ylpiperazin-1-yl)pyridin-4-amine
• CAS: 1027572-25-3
• 化学式: C₁₃H₁₃Cl₂FN₆
• 分子量: 343.191
• InChiKey: JCQKJLISIBXUMZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.5
• 重原子数：
  22
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  71.2
• 氢给体数：
  1
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  3,5-二氯-2-氟-6-(4-嘧啶-2-基-哌嗪-1-基)-吡啶-4-基胺 在 palladium on activated charcoal 甲酸铵 、 N,N-二异丙基乙胺 作用下， 以 N-甲基吡咯烷酮 、 甲醇 为溶剂， 反应 25.0h， 生成 2-(4-pyrimidin-2-yl-piperazin-1-yl)-6-pyrrolidin-1-yl-pyridine-4-ylamine
  参考文献：
  名称：

  Parallel synthesis of 4-amino-2,6-dialkylamino-pyridines

  摘要：

  In this letter a fast and useful parallel synthesis approach to 4-amino-2,6-dialkylamino-pyridines is described starting from commercially available 2,6-difluoro-3,5-dichloro-pyridine. Both symmetrical and unsymmetrical derivatives have been synthesized respectively in two or three steps in good yields. The method described is mild, adaptable to combinatorial purposes and applicable to a variety of amines. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(02)02585-6
• 作为产物：
  描述：

  1-(2-嘧啶基)哌嗪 、 4-氨基-3,5-二氯-2,6-二氟吡啶 在 N,N-二异丙基乙胺 作用下， 以 N-甲基吡咯烷酮 为溶剂， 反应 18.0h， 生成 3,5-二氯-2-氟-6-(4-嘧啶-2-基-哌嗪-1-基)-吡啶-4-基胺
  参考文献：
  名称：

  Parallel synthesis of 4-amino-2,6-dialkylamino-pyridines

  摘要：

  In this letter a fast and useful parallel synthesis approach to 4-amino-2,6-dialkylamino-pyridines is described starting from commercially available 2,6-difluoro-3,5-dichloro-pyridine. Both symmetrical and unsymmetrical derivatives have been synthesized respectively in two or three steps in good yields. The method described is mild, adaptable to combinatorial purposes and applicable to a variety of amines. (C) 2002 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0040-4039(02)02585-6

文献信息

• Parallel synthesis of 4-amino-2,6-dialkylamino-pyridines
  作者：Maria Menichincheri、Domenico Fusar Bassini、Markus Gude、Mauro Angiolini

  DOI：10.1016/s0040-4039(02)02585-6

  日期：2003.1

  In this letter a fast and useful parallel synthesis approach to 4-amino-2,6-dialkylamino-pyridines is described starting from commercially available 2,6-difluoro-3,5-dichloro-pyridine. Both symmetrical and unsymmetrical derivatives have been synthesized respectively in two or three steps in good yields. The method described is mild, adaptable to combinatorial purposes and applicable to a variety of amines. (C) 2002 Elsevier Science Ltd. All rights reserved.