[1,10]Phenanthroline-2,9-dicarboxylic acid 2-({3-[bis-(4-methoxy-phenyl)-phenyl-methoxy]-propyl}-amide) 9-[(3-hydroxy-propyl)-amide] | 1042682-91-6

• 分子结构分类: 有机化合物 - 苯类化合物
• 英文名称: [1,10]Phenanthroline-2,9-dicarboxylic acid 2-({3-[bis-(4-methoxy-phenyl)-phenyl-methoxy]-propyl}-amide) 9-[(3-hydroxy-propyl)-amide]
• CAS: 1042682-91-6
• 化学式: C₄₁H₄₀N₄O₆
• 分子量: 684.792
• InChiKey: YTKGUZYWPYRSFW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.04
• 重原子数：
  51.0
• 可旋转键数：
  15.0
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.22
• 拓扑面积：
  131.9
• 氢给体数：
  3.0
• 氢受体数：
  8.0

反应信息

• 作为反应物：
  描述：

  双(二异丙基氨基)(2-氰基乙氧基)膦 、 [1,10]Phenanthroline-2,9-dicarboxylic acid 2-({3-[bis-(4-methoxy-phenyl)-phenyl-methoxy]-propyl}-amide) 9-[(3-hydroxy-propyl)-amide] 在 二异丙基铵盐四氮唑 作用下， 以 二氯甲烷 为溶剂， 反应 1.5h， 以94%的产率得到9-N-[3-[bis(4-methoxyphenyl)-phenylmethoxy]propyl]-2-N-[3-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxypropyl]-1,10-phenanthroline-2,9-dicarboxamide
  参考文献：
  名称：

  Hairpin Mimics with Phenanthroline- and Bipyridine-Derived Linkers

  摘要：

  The synthesis and structural stabilities of modified oligonucleotide hairpins containing phenanthroline- and bipyridine-modified loops is reported. Phenanthroline (phen) and bipyridine (bipy) building blocks were synthesized, incorporated into DNA-oligonucleotides, and analyzed by thermal denaturation experiments. The so modified oligomers were found to form stable hairpin structures. Tm values were not affected by divalent transition metals.

  DOI：

  10.1080/15257770701508026
• 作为产物：
  描述：

  2,9-bis(3-hydroxypropylamide)-1,10-phenanthroline 、 4,4'-双甲氧基三苯甲基氯 在 吡啶 作用下， 以36%的产率得到[1,10]Phenanthroline-2,9-dicarboxylic acid 2-({3-[bis-(4-methoxy-phenyl)-phenyl-methoxy]-propyl}-amide) 9-[(3-hydroxy-propyl)-amide]
  参考文献：
  名称：

  Hairpin Mimics with Phenanthroline- and Bipyridine-Derived Linkers

  摘要：

  The synthesis and structural stabilities of modified oligonucleotide hairpins containing phenanthroline- and bipyridine-modified loops is reported. Phenanthroline (phen) and bipyridine (bipy) building blocks were synthesized, incorporated into DNA-oligonucleotides, and analyzed by thermal denaturation experiments. The so modified oligomers were found to form stable hairpin structures. Tm values were not affected by divalent transition metals.

  DOI：

  10.1080/15257770701508026

文献信息

• DNA containing phenanthroline- and phenanthrene-derived, non-nucleosidic base surrogates
  作者：Simon M. Langenegger、Robert Häner

  DOI：10.1016/j.tetlet.2004.10.068

  日期：2004.12

  Simple, non-nucleosidic phenanthroline- and phenanthrene derivatives have been synthesised and incorporated into oligodeoxynucleotides. Complementary strands containing the modified building blocks in opposite positions form stable hybrids. Thermal denaturation experiments show that the double strands containing the phenanthroline derivatives are more stable than the ones with the corresponding phenanthrenes

  已经合成了简单的非核苷菲咯啉和菲衍生物，并将其掺入寡脱氧核苷酸中。在相反位置包含修饰的构件的互补链形成稳定的杂种。热变性实验表明，含有菲咯啉衍生物的双链比具有相应菲的双链更稳定。此外，发现如果修饰的结构单元的接头太短，则双链体稳定性会大大降低。