4-(2-(5-amino-8-methylbenzo[f][1,7]naphthyridin-2-yl)ethyl)-3-methylphenyl dihydrogen phosphate | 1258595-16-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 4-(2-(5-amino-8-methylbenzo[f][1,7]naphthyridin-2-yl)ethyl)-3-methylphenyl dihydrogen phosphate
• 英文别名: [4-[2-(5-amino-8-methylbenzo[f][1,7]naphthyridin-2-yl)ethyl]-3-methylphenyl] dihydrogen phosphate
• CAS: 1258595-16-2
• 化学式: C₂₂H₂₂N₃O₄P
• 分子量: 423.408
• InChiKey: LXSDIGAHFCVUQJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.4
• 重原子数：
  30
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  119
• 氢给体数：
  3
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  4-(2-(5-amino-8-methylbenzo[f][1,7]naphthyridin-2-yl)ethyl)-3-methylphenyl dibenzyl phosphate 在 钯 氢气 、 氯仿 、 Sodium sulfate-III 作用下， 以 甲醇 为溶剂， 反应 18.0h， 以to give 4-(2-(5-amino-8-methylbenzo[f][1,7]naphthyridin-2-yl)ethyl)-3-methylphenyl dihydrogen phosphate (2) as a solid的产率得到4-(2-(5-amino-8-methylbenzo[f][1,7]naphthyridin-2-yl)ethyl)-3-methylphenyl dihydrogen phosphate
  参考文献：
  名称：

  COMPOUNDS AND COMPOSITIONS AS TLR ACTIVITY MODULATORS

  摘要：

  本发明提供了一类新型化合物、免疫原组合物和包含这些化合物的药物组合物，并提供使用这些化合物来治疗或预防与Toll-Like受体7相关的疾病或障碍的方法。在一个方面，这些化合物可用作佐剂，以增强疫苗的有效性。

  公开号：

  US20120237546A1

文献信息

• Compounds and compositions as TLR activity modulators
  申请人：Singh Manmohan

  公开号：US09950062B2

  公开（公告）日：2018-04-24

  The invention provides a novel class of compounds, immunogenic compositions and pharmaceutical compositions comprising such compounds and methods of using such compounds to treat or prevent diseases or disorders associated with Toll-Like Receptors 7. In one aspect, the compounds are useful as adjuvants for enhancing the effectiveness of a vaccine.

  这项发明提供了一类新型化合物，包括这类化合物的免疫原组合物和药物组合物，以及利用这类化合物治疗或预防与Toll样受体7相关的疾病或紊乱的方法。在一个方面，这些化合物可用作辅助剂，以增强疫苗的有效性。
• BENZONAPHTHYRIDINE-CONTAINING VACCINES
  申请人：O'Hagan Derek

  公开号：US20120263753A1

  公开（公告）日：2012-10-18

  The invention provides, inter alia, immunogenic compositions that comprise (a) a first antigen, (b) polymeric particles and (c) a benzonaphthyridine compound, which compositions elicits an immune response when administered to a vertebrate subject. The invention also provides, inter alia, methods of producing immunogenic compositions and methods for using immunogenic compositions (e.g., for treatment), among other benefits.

  本发明提供了包含(a)第一抗原、(b)聚合物颗粒和(c)苯并萘啶化合物的免疫原组合物，当向脊椎动物主体注射该组合物时，能够引发免疫反应。本发明还提供了制备免疫原组合物的方法以及使用免疫原组合物的方法（例如用于治疗），以及其他优点。
• ADSORPTION OF IMMUNOPOTENTIATORS TO INSOLUBLE METAL SALTS
  申请人：Singh Manmohan

  公开号：US20130274465A1

  公开（公告）日：2013-10-17

  Immunopotentiators can be adsorbed to insoluble metal salts, such as aluminium salts, to modify their pharmacokinetics, pharmacodynamics, intramuscular retention time, and/or immunostimulatory effect. Immunopotentiators are modified to introduce a moiety, such as a phosphonate group, which can mediate adsorption. These modified compounds can retain or improve their in vivo immunological activity even when delivered in an adsorbed form.

  免疫增强剂可以吸附到不溶性金属盐上，例如铝盐，以改变它们的药代动力学、药效学、肌肉内滞留时间和/或免疫刺激作用。免疫增强剂被修改以引入一个基团，例如磷酸酯基团，可以介导吸附。即使以吸附形式输送，这些修改的化合物仍然可以保持或改善它们的体内免疫活性。
• BENZONAPTHYRIDINE COMPOSITIONS AND USES THEREOF
  申请人：Otten Gillis

  公开号：US20130122042A1

  公开（公告）日：2013-05-16

  The present invention generally relates to compositions comprising benzonapthyridine small molecule immune potentiators (SMIPs) that are capable of stimulating or modulating an immune response in a subject that has had pre- or post-exposure to a pathogen such as hemorrhagic fever virus. Also provided are methods of preparing and using the SMIP compositions of the invention.

  本发明通常涉及包含苯并萘啶小分子免疫增强剂（SMIPs）的组合物，该组合物能够刺激或调节已经暴露于病原体（如出血热病毒）的受试者的免疫反应。还提供了制备和使用本发明中的SMIP组合物的方法。
• Adsorption of immunopotentiators to insoluble metal salts
  申请人：Novartis AG

  公开号：EP2719395A1

  公开（公告）日：2014-04-16

  Immunopotentiators can be adsorbed to insoluble metal salts, such as aluminium salts, to modify their pharmacokinetics, pharmacodynamics, intramuscular retention time, and/or immunostimulatory effect. Immunopotentiators are modified to introduce a moiety, such as a phosphonate group, which can mediate adsorption. These modified compounds can retain or improve their in vivo immunological activity even when delivered in an adsorbed form.

  免疫促效剂可吸附在铝盐等不溶性金属盐上，以改变其药代动力学、药效学、肌内滞留时间和/或免疫刺激效果。对免疫增强剂进行改性，引入一个可介导吸附的分子（如膦酸基）。这些经过修饰的化合物即使以吸附形式给药，也能保持或提高其体内免疫活性。