6-(4'-methyl-[2,2'-bipyridin]-4-yl)hexanoic acid | 938047-61-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 6-(4'-methyl-[2,2'-bipyridin]-4-yl)hexanoic acid
• 英文别名: 6-[2-(4-Methylpyridin-2-yl)pyridin-4-yl]hexanoic acid
• CAS: 938047-61-1
• 化学式: C₁₇H₂₀N₂O₂
• 分子量: 284.358
• InChiKey: GIJQADLLPAROLJ-UHFFFAOYSA-N

物化性质

• 沸点：
  488.1±45.0 °C(Predicted)
• 密度：
  1.133±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  21
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  63.1
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  6-(4'-methyl-[2,2'-bipyridin]-4-yl)hexanoic acid 在 N,N-二异丙基乙胺 、 三氟乙酸 、 N-[(dimethylamino)-3-oxo-1H-1,2,3-triazolo[4,5-b]pyridin-1-yl-methylene]-N-methylmethanaminium hexafluorophosphate 作用下， 以 二氯甲烷 、 N,N-二甲基甲酰胺 为溶剂， 反应 7.25h， 生成 N-(2-aminoethyl)-6-(4'-methyl-[2,2'-bipyridin]-4-yl)hexanamide
  参考文献：
  名称：

  광감각제, 광감각제를 포함하는 조성물 및 광역동 치료 방법

  摘要：

  本发明涉及一种化合物，其用化学式1表示为光感受剂，含有光感受剂的组合物以及光动力疗法方法。 （在此，R、R'和A如第1项权利要求中所定义。）

  公开号：

  KR20190125007A
• 作为产物：
  描述：

  5-溴戊腈 在 盐酸 、 正丁基锂 、 水 、 二异丙胺 作用下， 以 四氢呋喃 为溶剂， 反应 3.5h， 生成 6-(4'-methyl-[2,2'-bipyridin]-4-yl)hexanoic acid
  参考文献：
  名称：

  광감각제, 광감각제를 포함하는 조성물 및 광역동 치료 방법

  摘要：

  本发明涉及一种化合物，其用化学式1表示为光感受剂，含有光感受剂的组合物以及光动力疗法方法。 （在此，R、R'和A如第1项权利要求中所定义。）

  公开号：

  KR20190125007A

文献信息

• Electronically Neutral Metal Complexes As Biological Labels
  申请人：RUBIPY SCIENTIFIC, INC.

  公开号：US20160146826A1

  公开（公告）日：2016-05-26

  The invention relates to electronically neutral metal complexes as luminescent labels. The positive charge of the metal ion in the complex is neutralized by the negatively charged groups that are covalently linked to the nitrogen-containing diimine ligands, such as 2,2-bipyridine, 1,10-phenanthroline and their derivatives. The electronic neutrality reduces the impact of the metal complexes on the biological and/or biochemical activities of the labeled biomolecules, while the intensity of luminescent emission under electrochemical excitation is enhanced. These luminescent metal complex labels are useful in bioanalytic methodology development, with luminescence as the signal modality, such as electrochemiluminescence.

  该发明涉及作为发光标记的电子中性金属配合物。该配合物中金属离子的正电荷被共价连接到含氮双亚胺配体（如2,2-联吡啶，1,10-邻菲啰啉及其衍生物）上的带负电荷基团中和。电子中性减少了金属配合物对标记生物分子的生物和/或生化活性的影响，同时在电化学激发下增强了发光发射的强度。这些发光金属配合物标记在生物分析方法学的发展中非常有用，发光作为信号模态，如电化学发光。
• Light-driven artificial enzymes for selective oxidation of guanosine triphosphate using water-soluble POSS network polymers
  作者：Jong-Hwan Jeon、Kazuo Tanaka、Yoshiki Chujo

  DOI：10.1039/c4ob01115e

  日期：——

  The light-driven artificial enzymes were constructed to realize unnatural reactions concerning bio-significant molecules. In this manuscript, the guanosine triphosphate (GTP)-selective oxidation is reported using the network polymers composed of polyhedral oligomeric silsesquioxane (POSS). We synthesized the water-soluble POSS network polymer containing the naphthyridine ligands to capture GTP inside the networks and the ruthenium complexes to oxidize the captured GTP under light irradiation. Initially, the binding affinities of the guanosine nucleosides to the naphthyridine ligand inside the POSS network polymer were evaluated from the emission quenching experiments. Accordingly, it was observed that the naphthyridine ligand can form the stable complex only with GTP (Ka = 5.5 × 106 M−1). These results indicate that only GTP can be captured by the network polymer. Next, the photo-catalytic activity of the ruthenium complex-modified POSS network polymer was investigated. Finally, it was revealed that the network polymer can decompose GTP efficiently under light irradiation. This is the first example, to the best of our knowledge, to offer not only the GTP-selective host polymers but also the light-driven artificial enzyme for GTP oxidation.

  通过构建光驱动人工酶来实现有关重要生物分子的非自然反应。本手稿报道了利用多面体低聚硅倍半氧烷（POSS）组成的网络聚合物进行三磷酸鸟苷（GTP）选择性氧化。我们合成了含有萘啶配体的水溶性 POSS 网络聚合物，可在网络内捕获 GTP，而钌配合物则可在光照射下氧化捕获的 GTP。首先，通过发射淬灭实验评估了鸟苷核苷与 POSS 网络聚合物内的萘啶配体的结合亲和力。结果表明，萘啶配体只能与 GTP 形成稳定的复合物（Ka = 5.5 × 106 M-1）。这些结果表明，只有 GTP 能被网络聚合物捕获。接着，研究了钌络合物修饰的 POSS 网络聚合物的光催化活性。结果表明，该网络聚合物在光照射下能有效分解 GTP。据我们所知，这是第一个不仅提供 GTP 选择性宿主聚合物，而且还提供光驱动 GTP 氧化人工酶的实例。
• Direct Labeling of 5-Methylcytosine and Its Applications
  作者：Kazuo Tanaka、Kazuki Tainaka、Taku Kamei、Akimitsu Okamoto

  DOI：10.1021/ja068660c

  日期：2007.5.1

  Cytosine methylation is one of the most important epigenetic events, and much effort has been directed to develop a simple reaction for methylcytosine detection. In this paper, we describe the design of tag-attachable ligands for direct methylcytosine labeling and their application to fluorescent and electrochemical assays. The effect of the location of bipyridine substituents on the efficiency of osmium complexation at methylcytosine was initially investigated. As a result, a bipyridine derivative with a substituent at the C4 position showed efficient complexation at the methylcytosine residue of single-stranded DNA in a reaction mixture containing potassium osmate and potassium hexacyanoferrate(III). On the basis of this result, a bipyridine derivative with a tag-attachable amino linker at the C4 position was synthesized. The efficiency of metal complex formation in the presence of the osmate and the synthetic ligand was clearly changed by the presence/absence of a methyl group at the C5 position of cytosine. The succinimidyl esters of functional labeling units were then attached to the bipyridine ligand fixed on the methylcytosine. These labels attached to methylcytosine enabled us to detect the target methylcytosine in DNA both fluorometrically and electrochemically. For example, we were able to fluorometrically obtain information on the methylation status at a specific site by means of fluorescence resonance energy transfer from a hybridized fluorescent DNA probe to a fluorescent label on methylcytosine. In addition, by the combination of electrochemically labeled methylcytosine and an electrode modified by probe DNAs, a methylcytosine-selective characteristic current signal was observed. This direct labeling of methylcytosine is a conceptually new methylation detection assay with many merits different from conventional assays.
• An Osmium−DNA Interstrand Complex:  Application to Facile DNA Methylation Analysis
  作者：Kazuo Tanaka、Kazuki Tainaka、Tadashi Umemoto、Akiko Nomura、Akimitsu Okamoto

  DOI：10.1021/ja076140r

  日期：2007.11.1

  Nucleic acids often acquire new functions by forming a variety of complexes with metal ions. Osmium, in an oxidized state, also reacts with C5-methylated pyrimidines. However, control of the sequence specificity of osmium complexation with DNA is still immature, and the value of the resulting complexes is unknown. We have designed a bipyridine-attached adenine derivative for sequence-specific osmium complexation. Sequence-specific osmium complexation was achieved by hybridization of a short DNA molecule containing this functional nucleotide to a target DNA sequence and resulted in the formation of a cross-linked structure. The interstrand cross-link clearly distinguished methylated cytosines from unmethylated cytosines and was used to quantify the degree of methylation at a specific cytosine in the genome.