| 1236459-00-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 偶氮苯
• CAS: 1236459-00-9
• 化学式: C₄₀H₄₄N₄O₈
• 分子量: 708.811
• InChiKey: RPENATBWZKIFPU-NAIFZEOOSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.63
• 重原子数：
  52.0
• 可旋转键数：
  18.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  153.98
• 氢给体数：
  2.0
• 氢受体数：
  10.0

反应信息

• 作为反应物：
  描述：

  以 二氯甲烷 为溶剂， 生成 C₄₀H₄₄N₄O₈
  参考文献：
  名称：

  C2-Symmetric azobenzene-amino acid conjugates and their inhibition of Subtilisin Kexin Isozyme-1

  摘要：

  C-2-Symmetric azobenzene-amino acid/peptide hybrids containing stable E-azo moiety have been synthesized. Upon irradiation with long wavelength UV, these compounds isomerized to the Z-form, whose thermal reisomerization to the E isomer slowed down considerably. These compounds exhibited in vitro moderate to strong inhibition of mammalian cellular protease Subtilisin Kexin Isozyme-1, also called Site 1 Protease, which plays vital roles in cholesterol synthesis, lipid metabolism, bone formation, and viral infections. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.04.101
• 作为产物：
  描述：

  C₄₀H₄₄N₄O₈ 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  C2-Symmetric azobenzene-amino acid conjugates and their inhibition of Subtilisin Kexin Isozyme-1

  摘要：

  C-2-Symmetric azobenzene-amino acid/peptide hybrids containing stable E-azo moiety have been synthesized. Upon irradiation with long wavelength UV, these compounds isomerized to the Z-form, whose thermal reisomerization to the E isomer slowed down considerably. These compounds exhibited in vitro moderate to strong inhibition of mammalian cellular protease Subtilisin Kexin Isozyme-1, also called Site 1 Protease, which plays vital roles in cholesterol synthesis, lipid metabolism, bone formation, and viral infections. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.04.101