12-(3-(pyridin-3-yl)propoxy)dodecan-1-amine | 1333383-59-7

• 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: 12-(3-(pyridin-3-yl)propoxy)dodecan-1-amine
• 英文别名: 12-(3-Pyridin-3-ylpropoxy)dodecan-1-amine
• CAS: 1333383-59-7
• 化学式: C₂₀H₃₆N₂O
• 分子量: 320.519
• InChiKey: DWCYQUPZZWNUSN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  23
• 可旋转键数：
  16
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.75
• 拓扑面积：
  48.1
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  二碳酸二叔丁酯 、 12-(3-(pyridin-3-yl)propoxy)dodecan-1-amine 以 二氯甲烷 为溶剂， 反应 2.5h， 以75%的产率得到1,1-dimethylethyl [12-(3-pyridinylpropoxy)dodecyl]carbamate
  参考文献：
  名称：

  Synthesis and Evaluation of Antimalarial Activity of Oxygenated 3-alkylpyridine Marine Alkaloid Analogues

  摘要：

  A series of new oxygenated analogues of marine 3‐alkylpyridine alkaloids were prepared from 3‐pyridinepropanol in few steps and in good yields. The key step for the synthesis of these compounds was a Williamson etherification under phase‐transfer conditions. All new compounds were evaluated for their antiplasmodial activity and cytotoxicity. A significant reduction in parasitaemia was observed for some of the prepared compounds, and the majority of them exhibited a selectivity index (SI) ranging from 2.78 to 15.58, which suggests that these compounds may be a promising class of substances with antimalarial activity.

  DOI：

  10.1111/j.1747-0285.2011.01154.x
• 作为产物：
  描述：

  3-(3-((12-azidododecyl)oxy)propyl)pyridine 在 lithium aluminium tetrahydride 作用下， 以 四氢呋喃 为溶剂， 反应 5.0h， 以72%的产率得到12-(3-(pyridin-3-yl)propoxy)dodecan-1-amine
  参考文献：
  名称：

  Synthesis and Evaluation of Antimalarial Activity of Oxygenated 3-alkylpyridine Marine Alkaloid Analogues

  摘要：

  A series of new oxygenated analogues of marine 3‐alkylpyridine alkaloids were prepared from 3‐pyridinepropanol in few steps and in good yields. The key step for the synthesis of these compounds was a Williamson etherification under phase‐transfer conditions. All new compounds were evaluated for their antiplasmodial activity and cytotoxicity. A significant reduction in parasitaemia was observed for some of the prepared compounds, and the majority of them exhibited a selectivity index (SI) ranging from 2.78 to 15.58, which suggests that these compounds may be a promising class of substances with antimalarial activity.

  DOI：

  10.1111/j.1747-0285.2011.01154.x

文献信息

• Pseudomonas aeruginosa inhibitor compounds
  申请人：Centre National de la Recherche Scientifique (CNRS)

  公开号：US10908153B2

  公开（公告）日：2021-02-02

  The invention relates to a method of identifying molecules which inhibit the virulence machinery of Pseudomonas aeruginosa, to a device for identifying a molecule which inhibits the virulence machinery of Pseudomonas aeruginosa, to novel compounds which inhibit the virulence machinery of Pseudomonas aeruginosa, to compounds for use for preventing and/or treating a pathogenic infection caused by Pseudomonas aeruginosa and also to pharmaceutical compositions for preventing and/or treating a pathogenic infection caused by Pseudomonas aeruginosa.

  本发明涉及一种鉴定抑制铜绿假单胞菌毒力机制的分子的方法，涉及一种鉴定抑制铜绿假单胞菌毒力机制的分子的装置，涉及抑制铜绿假单胞菌毒力机制的新型化合物，涉及用于预防和/或治疗铜绿假单胞菌引起的病原体感染的化合物，还涉及用于预防和/或治疗铜绿假单胞菌引起的病原体感染的药物组合物。
• COMPOSES INHIBITEURS DE PSEUDOMONAS AERUGINOSA
  申请人：Centre National de la Recherche Scientifique (CNRS)

  公开号：EP3322421B1

  公开（公告）日：2020-06-10
• Pseudomonas Aeruginosa Inhibitor Compounds
  申请人：Centre National de la Recherche Scientifique (CNRS)

  公开号：US20180209969A1

  公开（公告）日：2018-07-26

  The invention relates to a method of identifying molecules which inhibit the virulence machinery of Pseudomonas aeruginosa, to a device for identifying a molecule which inhibits the virulence machinery of Pseudomonas aeruginosa, to novel compounds which inhibit the virulence machinery of Pseudomonas aeruginosa, to compounds for use for preventing and/or treating a pathogenic infection caused by Pseudomonas aeruginosa and also to pharmaceutical compositions for preventing and/or treating a pathogenic infection caused by Pseudomonas aeruginosa.
• [EN] PSEUDOMONAS AERUGINOSA INHIBITOR COMPOUNDS<br/>[FR] COMPOSES INHIBITEURS DE PSEUDOMONAS AERUGINOSA
  申请人：CENTRE NAT DE LA RECH SCIENT (CNRS)

  公开号：WO2017009344A1

  公开（公告）日：2017-01-19

  L'invention concerne un procédé d'identification de molécules inhibitrice de la machinerie de virulence de Pseudomonas aeruginosa, un dispositif pour l'identification d'une molécule inhibitrice de la machinerie de virulence de Pseudomonas aeruginosa, des composés nouveaux inhibiteurs de la machinerie de virulence de Pseudomonasaruginosa, des composés pour leur utilisation pour prévenir et/ou traiter une infection pathogène causée par Pseudomonasaeruginosaainsi que des compositions pharmaceutiques pour prévenir et/ou traiter une infection pathogène causée par Pseudomonasaeruginosa.