dimethyl (2S,7S)-3,6-diaza-4,5-dioxo-2,7-dimethyloctano-1,8-dicarboxylate | 144901-96-2

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: dimethyl (2S,7S)-3,6-diaza-4,5-dioxo-2,7-dimethyloctano-1,8-dicarboxylate
• 英文别名: N,N'-oxalyl-di-L-alanine dimethyl ester；N,N'-Oxalyl-di-L-alanin-dimethylester；methyl (2S)-2-[[2-[[(2S)-1-methoxy-1-oxopropan-2-yl]amino]-2-oxoacetyl]amino]propanoate
• CAS: 144901-96-2
• 化学式: C₁₀H₁₆N₂O₆
• 分子量: 260.247
• InChiKey: OPHSBWFHTSMVBM-WDSKDSINSA-N

物化性质

• 密度：
  1.220±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  -0.1
• 重原子数：
  18
• 可旋转键数：
  6
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  111
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  dimethyl (2S,7S)-3,6-diaza-4,5-dioxo-2,7-dimethyloctano-1,8-dicarboxylate 以 甲醇 、 水 为溶剂， 反应 144.0h， 生成
  参考文献：
  名称：

  Enantioselective Inclusion of Alcohols by Solvent-Controlled Assembled Flexible Metal–Organic Frameworks

  摘要：

  Through judicious choice of the ligands and patient regulation of the solvent conditions, three unique chiral coordination polymeric isomers have been synthesized. Their structures, gas adsorption, and structural interconversion have been studied. One of the isomers displays dynamic behavior, and its use in the enantioselective separation of chiral alcohols has also been reported.

  DOI：

  10.1021/ic500436g
• 作为产物：
  描述：

  N,N'-oxalyl-di-L-alanine diethyl ester 在 sodium hydroxide 、 乙醚 、 乙醇 作用下， 生成 dimethyl (2S,7S)-3,6-diaza-4,5-dioxo-2,7-dimethyloctano-1,8-dicarboxylate
  参考文献：
  名称：

  Stereoisomerism of N,N'-Oxalylbis-(alanine) Derivatives¹

  摘要：

  DOI：

  10.1021/ja01576a038

文献信息

• Oxalopeptides as core motifs for protein design
  作者：Darshan Ranganathan、Narendra K. Vaish、Kavita Shah、Raja Roy、K. P. Madhusudanan

  DOI：10.1039/c39930000092

  日期：——

  Oxalopeptides are demonstrated to be useful core motifs for bi-directional chain elongation leading to peptide homologues with interesting folding behaviour, thus constituting a useful strategy for protein backbone modification.

  草酰肽被证明是双向链延伸的有效核心结构，能够产生具有有趣折叠特性的肽同系物，因此构成了一种有用的蛋白质主链修饰策略。
• A simple synthesis of chiral macrocyclic tetraamides derived from α-amino acids
  作者：Tomasz Zieliński、Michał Achmatowicz、Janusz Jurczak

  DOI：10.1016/s0957-4166(02)00506-2

  日期：2002.9

  Bisamidation of oxalyl chloride using four L-alpha-amino acid esters afforded chiral diesters which were reacted with three alpha,omega-diainines under high-pressure conditions (10 kbar) to give macrocyclic tetramides of C-2-symmetry. (C) 2002 Published by Elsevier Science Ltd.
• Enantioselective Inclusion of Alcohols by Solvent-Controlled Assembled Flexible Metal–Organic Frameworks
  作者：Lang Lin、Rongmin Yu、Xiao-Yuan Wu、Wen-Bin Yang、Jian Zhang、Xiang-Guang Guo、Zu-Jin Lin、Can-Zhong Lu

  DOI：10.1021/ic500436g

  日期：2014.5.19

  Through judicious choice of the ligands and patient regulation of the solvent conditions, three unique chiral coordination polymeric isomers have been synthesized. Their structures, gas adsorption, and structural interconversion have been studied. One of the isomers displays dynamic behavior, and its use in the enantioselective separation of chiral alcohols has also been reported.
• Stereoisomerism of N,N'-Oxalylbis-(alanine) Derivatives¹
  作者：Walter R. Hearn、Richard A. Hendry

  DOI：10.1021/ja01576a038

  日期：1957.10