Ethanedial bis(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)methylhydrazone dihydroiodide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮卓类
• 英文名称: Ethanedial bis(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)methylhydrazone dihydroiodide
• 英文别名: N-methyl-N-[(E)-[(2E)-2-[methyl(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)hydrazinylidene]ethylidene]amino]-4,5,6,7-tetrahydro-1H-1,3-diazepin-2-amine;hydroiodide
• 化学式: C₁₄H₂₆N₈*2HI
• 分子量: 562.239
• InChiKey: YYRJPOJSUCVIJH-BYCVLTJGSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.92
• 重原子数：
  23
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.71
• 拓扑面积：
  80
• 氢给体数：
  3
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  草酸醛 、 N-Methyl-N-(4,5,6,7-tetrahydro-1H-[1,3]diazepin-2-yl)-hydrazine; hydriodide 在 水 、 溶剂黄146 作用下， 反应 1.0h， 以49%的产率得到Ethanedial bis(4,5,6,7-tetrahydro-1H-1,3-diazepin-2-yl)methylhydrazone dihydroiodide
  参考文献：
  名称：

  Synthesis and preliminary antileukemic studies of cyclic mitoguazone analogues

  摘要：

  Analogues of mitoguazone bearing a terminal amidino group as a part of the seven-membered ring of 1,3-diazepine and six-membered ring of pyrimidine were prepared in order to evaluate in vivo antileukemic action towards L1210 leukemia in mice. preliminary pharmacological screening showed that the investigated compounds increase the life span (T/C%) of the treated mice in comparison with the untreated animals. The strongest antineoplastic effect was exhibited by compound 8. (C) 1998 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(98)00011-1

文献信息

• Synthesis and preliminary antileukemic studies of cyclic mitoguazone analogues
  作者：Izabella Kr żel、Julita Graczyk

  DOI：10.1016/s0014-827x(98)00011-1

  日期：1998.3

  Analogues of mitoguazone bearing a terminal amidino group as a part of the seven-membered ring of 1,3-diazepine and six-membered ring of pyrimidine were prepared in order to evaluate in vivo antileukemic action towards L1210 leukemia in mice. preliminary pharmacological screening showed that the investigated compounds increase the life span (T/C%) of the treated mice in comparison with the untreated animals. The strongest antineoplastic effect was exhibited by compound 8. (C) 1998 Elsevier Science S.A. All rights reserved.