2-(chloromethyl)triazole | 80199-90-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-(chloromethyl)triazole
• 英文别名: 2-(Chloromethyl)-2H-1,2,3-triazole
• CAS: 80199-90-2
• 化学式: C₃H₄ClN₃
• mdl: MFCD19235522
• 分子量: 117.538
• InChiKey: PRGPKCHJKNCEOZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.9
• 重原子数：
  7
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.333
• 拓扑面积：
  30.7
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  2-(chloromethyl)triazole 在 sodium azide 作用下， 以 二甲基亚砜 为溶剂， 以91%的产率得到2-(叠氮甲基)-2H-1,2,3-三唑
  参考文献：
  名称：

  Efficient Synthesis of 2-Substituted-1,2,3-triazoles

  摘要：

  In this three-component reaction, alkynes undergo a copper(I)-catalyzed cycloaddition with sodium azide and formaldehyde to yield 2-hydroxymethyl-2H-1,2,3-triazoles, which are useful intermediates that can be readily converted to polyfunctional molecules. The hydroxymethyl group can also be removed, providing convenient access to NH-1,2,3-triazoles. The reaction is experimentally simple and readily scalable.

  DOI：

  10.1021/ol8006748
• 作为产物：
  描述：

  1H-1,2,3-三氮唑 、 聚合甲醛 在 甲基磺酰氯 、 三乙胺 作用下， 以 乙醇 、 水 、 二氯甲烷 为溶剂， 以34%的产率得到2-(chloromethyl)triazole
  参考文献：
  名称：

  Efficient Synthesis of 2-Substituted-1,2,3-triazoles

  摘要：

  In this three-component reaction, alkynes undergo a copper(I)-catalyzed cycloaddition with sodium azide and formaldehyde to yield 2-hydroxymethyl-2H-1,2,3-triazoles, which are useful intermediates that can be readily converted to polyfunctional molecules. The hydroxymethyl group can also be removed, providing convenient access to NH-1,2,3-triazoles. The reaction is experimentally simple and readily scalable.

  DOI：

  10.1021/ol8006748

文献信息

• NOVEL PYRROLOPYRIMIDINE COMPOUND OR SALT THEREOF, PHARMACEUTICAL COMPOSITION CONTAINING SAME, ESPECIALLY AGENT FOR PREVENTION AND/OR TREATMENT OF TUMORS ETC BASED ON NAE INHIBITORY EFFECT
  申请人：TAIHO PHARMACEUTICAL CO., LTD.

  公开号：US20170066772A1

  公开（公告）日：2017-03-09

  An object to be solved by the present invention is to provide a novel pyrrolopyrimidine compound or a salt thereof having an NAE inhibitory action and a cell growth inhibitory effect. The present invention provides a compound or a salt thereof represented by Formula (A), as well as an NAE inhibitor, a pharmaceutical composition, and an antitumor agent comprising the compound or a salt thereof as an active ingredient.

  本发明要解决的问题是提供一种具有NAE抑制作用和细胞生长抑制作用的新型吡咯吡嘧啶化合物或其盐。本发明提供了由化学式（A）表示的化合物或其盐，以及一种NAE抑制剂、含有该化合物或其盐作为活性成分的药物组合物和抗肿瘤剂。
• EP3395345
  申请人：——

  公开号：——

  公开（公告）日：——
• Efficient Synthesis of 2-Substituted-1,2,3-triazoles
  作者：Jarosław Kalisiak、K. Barry Sharpless、Valery V. Fokin

  DOI：10.1021/ol8006748

  日期：2008.8.7

  In this three-component reaction, alkynes undergo a copper(I)-catalyzed cycloaddition with sodium azide and formaldehyde to yield 2-hydroxymethyl-2H-1,2,3-triazoles, which are useful intermediates that can be readily converted to polyfunctional molecules. The hydroxymethyl group can also be removed, providing convenient access to NH-1,2,3-triazoles. The reaction is experimentally simple and readily scalable.