6-methyl-2-formylamino-4-chloropyrimidine | 1412896-92-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 6-methyl-2-formylamino-4-chloropyrimidine
• 英文别名: N-(4-chloro-6-methylpyrimidin-2-yl)formamide
• CAS: 1412896-92-4
• 化学式: C₆H₆ClN₃O
• 分子量: 171.586
• InChiKey: ZHSWAMQMXLAELA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  54.9
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  6-methyl-2-formylamino-4-chloropyrimidine 在 potassium hydroxide 、 sodium hydroxide 作用下， 以 乙醇 为溶剂， 反应 4.0h， 生成 2-amino-4-benzylthio-6-methylpyrimidine
  参考文献：
  名称：

  Synthesis and biological activity of hydrochlorides of benzyl ethers of pyrimidin-4(3H)-thiones and related compounds

  摘要：

  Hydrochlorides of benzyl ether of 2-amino-6-methylpyrimidin-4(3H)-thione and its analogs were synthesized and biological activity of the synthesized compounds was studied.

  DOI：

  10.1134/s1070363215010144
• 作为产物：
  描述：

  6-methyl-2-formylaminopyrimidin-4(3H)-one 在 三氯氧磷 作用下， 反应 1.5h， 以43%的产率得到6-methyl-2-formylamino-4-chloropyrimidine
  参考文献：
  名称：

  Effect of the structural modification of 2-benzylamino-4-(4-iodophenyl)amino-6-methylpyrimidine on the biological activity of its derivatives

  摘要：

  Modification of the aliphatic-aromatic moiety in the 2-benzylmino-4-(4-iodophenyl)amino-6-methylpyrimidine leads to a change in the site of biological action of the formed structural analogs.

  DOI：

  10.1134/s1070363212090198

文献信息

• Synthesis and biological activity of the 2-amino-4-(4-iodophenyl)amino-6-methylpyrimidine isosteric analogs
  作者：A. V. Erkin、V. I. Krutikov

  DOI：10.1134/s1070363213030213

  日期：2013.3

  Transformation of the structure of 6-methylisocytosine results in the isosteric analogs of 2-amino-4-(4-iodophenyl)amino-6-methylpyrimidine exhibiting tuberculocidal properties. The level of biological activity of the synthesized compounds depends on the site of location of the halogen atom.
• Synthesis and biological activity of hydrochlorides of benzyl ethers of pyrimidin-4(3H)-thiones and related compounds
  作者：A. V. Erkin、V. V. Gurzhii、V. I. Krutikov

  DOI：10.1134/s1070363215010144

  日期：2015.1

  Hydrochlorides of benzyl ether of 2-amino-6-methylpyrimidin-4(3H)-thione and its analogs were synthesized and biological activity of the synthesized compounds was studied.
• Effect of the structural modification of 2-benzylamino-4-(4-iodophenyl)amino-6-methylpyrimidine on the biological activity of its derivatives
  作者：A. V. Erkin、V. I. Krutikov

  DOI：10.1134/s1070363212090198

  日期：2012.9

  Modification of the aliphatic-aromatic moiety in the 2-benzylmino-4-(4-iodophenyl)amino-6-methylpyrimidine leads to a change in the site of biological action of the formed structural analogs.