N,N'-bis(2-aminoethyl)-2-[5-(tetrahydropyran-2-yloxy)pentyl]malonodiamide | 454714-06-8

• 分子结构分类: 有机化合物 - 脂质和类脂质分子 - 脂肪酰基
• 英文名称: N,N'-bis(2-aminoethyl)-2-[5-(tetrahydropyran-2-yloxy)pentyl]malonodiamide
• 英文别名: N,N'-bis(2-aminoethyl)-2-[5-(oxan-2-yloxy)pentyl]propanediamide
• CAS: 454714-06-8
• 化学式: C₁₇H₃₄N₄O₄
• 分子量: 358.481
• InChiKey: OQZZNCXPTQKGSS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.5
• 重原子数：
  25
• 可旋转键数：
  13
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.88
• 拓扑面积：
  129
• 氢给体数：
  4
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  N,N'-bis(2-aminoethyl)-2-[5-(tetrahydropyran-2-yloxy)pentyl]malonodiamide 在 对甲苯磺酸 作用下， 以 甲醇 为溶剂， 生成 tert-butyl N-[2-[[7-hydroxy-2-[2-[(2-methylpropan-2-yl)oxycarbonylamino]ethylcarbamoyl]heptanoyl]amino]ethyl]carbamate
  参考文献：
  名称：

  Nitroimidazoles and hypoxia imaging: synthesis of three technetium-99m complexes bearing a nitroimidazole group: biological results

  摘要：

  Several Tc-99m complexes were synthesized, substituted with a nitroimidazole group, in order to visualize hypoxic tissues. The complexes were tested on rats (isolated hearts) and showed no significant uptake under hypoxic conditions. (C) 2000 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(00)00593-x
• 作为产物：
  描述：

  2-[(5-氯戊基)氧基]四氢-2H-吡喃 在 sodium ethanolate 作用下， 以 乙醇 为溶剂， 反应 75.0h， 生成 N,N'-bis(2-aminoethyl)-2-[5-(tetrahydropyran-2-yloxy)pentyl]malonodiamide
  参考文献：
  名称：

  Synthesis of two novel oxocyclam-binding technetium complexes containing an analogue of cocaine

  摘要：

  为了可视化和量化多巴胺转运体，我们研究了用锝-99 m (99mTc)标记的两种新型配体的合成。通过多步合成，得到了两种具有托烷骨架和大环络合基团的目标配体。取代基的选择和位置与多巴胺转运体的结构相适应。研究人员对这些配体进行了 99mTc 放射性标记，结果表明它们是 SPECT 成像的理想候选物质。版权所有 © 2002 约翰威利父子有限公司。

  DOI：

  10.1002/jlcr.560

文献信息

• Nitroimidazoles and hypoxia imaging: synthesis of three technetium-99m complexes bearing a nitroimidazole group: biological results
  作者：Françoise Riché、Amaury du Moulinet d'Hardemare、Sandrine Sèpe、Laurent Riou、Daniel Fagret、Michel Vidal

  DOI：10.1016/s0960-894x(00)00593-x

  日期：2001.1

  Several Tc-99m complexes were synthesized, substituted with a nitroimidazole group, in order to visualize hypoxic tissues. The complexes were tested on rats (isolated hearts) and showed no significant uptake under hypoxic conditions. (C) 2000 Elsevier Science Ltd. All rights reserved.
• Synthesis of two novel oxocyclam-binding technetium complexes containing an analogue of cocaine
  作者：F. Turpin、F. Masri、F. Riché、E. Berthommier、P. Emond、M. Vidal、P. Auzeloux、C. Loc'h、N. Neuquelman、L. Mauclaire

  DOI：10.1002/jlcr.560

  日期：2002.4

  In order to visualize and quantify dopamine transporters, the synthesis of two novel ligands labelled with technetium-99 m (99mTc) has been investigated. A multi-step synthesis afforded two target ligands with a tropane skeleton and a macrocyclic complexing moiety. The choice and the position of substituents are in adequation with dopamine transporter structure. The radiolabelling of these ligands with 99mTc has been studied and the results make them good candidates for SPECT imaging. Copyright © 2002 John Wiley & Sons, Ltd.

  为了可视化和量化多巴胺转运体，我们研究了用锝-99 m (99mTc)标记的两种新型配体的合成。通过多步合成，得到了两种具有托烷骨架和大环络合基团的目标配体。取代基的选择和位置与多巴胺转运体的结构相适应。研究人员对这些配体进行了 99mTc 放射性标记，结果表明它们是 SPECT 成像的理想候选物质。版权所有 © 2002 约翰威利父子有限公司。