2-(N-(环丙基甲基)-N-(2,6-二溴苯基)氨基)-2-咪唑啉 | 66542-09-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 2-(N-(环丙基甲基)-N-(2,6-二溴苯基)氨基)-2-咪唑啉
• 英文名称: 2--2-imidazoline
• 英文别名: STH 2148；cyclopropylmethyl-(2,6-dibromo-phenyl)-(4,5-dihydro-1H-imidazol-2-yl)-amine；2-(N-(Cyclopropylmethyl)-N-(2,6-dibromophenyl)amino)-2-imidazoline；N-(cyclopropylmethyl)-N-(2,6-dibromophenyl)-4,5-dihydro-1H-imidazol-2-amine
• CAS: 66542-09-4
• 化学式: C₁₃H₁₅Br₂N₃
• 分子量: 373.09
• InChiKey: ZRUVYWZNRHMCBG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  18
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.46
• 拓扑面积：
  27.6
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 海关编码：
  2933290090

反应信息

• 作为产物：
  描述：

  环丙基甲基氯 、 N-(2,6-二溴苯基)-4,5-二氢-1H-咪唑-2-胺 在 sodium carbonate 作用下， 以 甲醇 为溶剂， 反应 40.0h， 以38.8%的产率得到2-(N-(环丙基甲基)-N-(2,6-二溴苯基)氨基)-2-咪唑啉
  参考文献：
  名称：

  Chemistry, pharmacology, and structure-activity relationships with a new type of imidazolines exerting a specific bradycardic action at a cardiac site

  摘要：

  The reaction of alkyl halides with 2-(arylimino)imidazolidines (I) leads to imidazoline derivatives II, in which the side chain is situated at the bridge nitrogen atom between the phenyl group and the imidazoline ring. The new imidazolines (II) exert a specific bradycardic action at a cardiac site. Syntheses and pharmacology are shown and structure-activity relationships discussed. The results reveal that the imidazoline derivatives (II) represent a class of compounds with a novel type of cardiac action.

  DOI：

  10.1021/jm00185a013

文献信息

• STAEHLE H.; DANIEL H.; KOEBINGER W.; LILLIE C.; PICHLER L., J. MED. CHEM., 1980, 23, NO 11, 1217-1222
  作者：STAEHLE H.、 DANIEL H.、 KOEBINGER W.、 LILLIE C.、 PICHLER L.

  DOI：——

  日期：——
• Chemistry, pharmacology, and structure-activity relationships with a new type of imidazolines exerting a specific bradycardic action at a cardiac site
  作者：Helmut Staehle、Helmut Daniel、Walter Kobinger、Christian Lillie、Ludwig Pichler

  DOI：10.1021/jm00185a013

  日期：1980.11

  The reaction of alkyl halides with 2-(arylimino)imidazolidines (I) leads to imidazoline derivatives II, in which the side chain is situated at the bridge nitrogen atom between the phenyl group and the imidazoline ring. The new imidazolines (II) exert a specific bradycardic action at a cardiac site. Syntheses and pharmacology are shown and structure-activity relationships discussed. The results reveal that the imidazoline derivatives (II) represent a class of compounds with a novel type of cardiac action.