Methyl 4-[2-[2-[10-[[2-[2-[(4-methoxy-4-oxobutanoyl)amino]phenyl]-2-oxoacetyl]amino]decylamino]-2-oxoacetyl]anilino]-4-oxobutanoate | 1333311-08-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Methyl 4-[2-[2-[10-[[2-[2-[(4-methoxy-4-oxobutanoyl)amino]phenyl]-2-oxoacetyl]amino]decylamino]-2-oxoacetyl]anilino]-4-oxobutanoate
• 英文别名: methyl 4-[2-[2-[10-[[2-[2-[(4-methoxy-4-oxobutanoyl)amino]phenyl]-2-oxoacetyl]amino]decylamino]-2-oxoacetyl]anilino]-4-oxobutanoate
• CAS: 1333311-08-2
• 化学式: C₃₆H₄₆N₄O₁₀
• 分子量: 694.782
• InChiKey: ZFUVGIFKZWNAQG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  50
• 可旋转键数：
  25
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  203
• 氢给体数：
  4
• 氢受体数：
  10

反应信息

• 作为反应物：
  描述：

  Methyl 4-[2-[2-[10-[[2-[2-[(4-methoxy-4-oxobutanoyl)amino]phenyl]-2-oxoacetyl]amino]decylamino]-2-oxoacetyl]anilino]-4-oxobutanoate 在 potassium hydroxide 、 盐酸 作用下， 以 甲醇 、 水 、 乙酸乙酯 为溶剂， 反应 1.5h， 以63%的产率得到4-[2-[2-[10-[[2-[2-(3-Carboxypropanoylamino)phenyl]-2-oxoacetyl]amino]decylamino]-2-oxoacetyl]anilino]-4-oxobutanoic acid
  参考文献：
  名称：

  Facile ring-opening of N-acylisatins for the development of novel peptidomimetics

  摘要：

  A range of novel mono- and bis-glyoxylamide peptidomimetics were prepared via the facile ring-opening of N-acylisatins with amino acids and peptide derivatives. The ring-opening of N-acylisatins with dipeptides and tripeptides was discovered to be the most efficient strategy for the synthesis of second and third generation glyoxylamides. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.07.036
• 作为产物：
  描述：

  癸二胺 、 methyl 4-(2,3-dioxoindolin-1-yl)-4-oxo-butanoate 在 4-二甲氨基吡啶 作用下， 以 二氯甲烷 为溶剂， 反应 24.0h， 以35%的产率得到Methyl 4-[2-[2-[10-[[2-[2-[(4-methoxy-4-oxobutanoyl)amino]phenyl]-2-oxoacetyl]amino]decylamino]-2-oxoacetyl]anilino]-4-oxobutanoate
  参考文献：
  名称：

  Facile ring-opening of N-acylisatins for the development of novel peptidomimetics

  摘要：

  A range of novel mono- and bis-glyoxylamide peptidomimetics were prepared via the facile ring-opening of N-acylisatins with amino acids and peptide derivatives. The ring-opening of N-acylisatins with dipeptides and tripeptides was discovered to be the most efficient strategy for the synthesis of second and third generation glyoxylamides. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.07.036

文献信息

• Facile ring-opening of N-acylisatins for the development of novel peptidomimetics
  作者：Wai Ching Cheah、Kasey Wood、David StC Black、Naresh Kumar

  DOI：10.1016/j.tet.2011.07.036

  日期：2011.9

  A range of novel mono- and bis-glyoxylamide peptidomimetics were prepared via the facile ring-opening of N-acylisatins with amino acids and peptide derivatives. The ring-opening of N-acylisatins with dipeptides and tripeptides was discovered to be the most efficient strategy for the synthesis of second and third generation glyoxylamides. (C) 2011 Elsevier Ltd. All rights reserved.