(4-(benzyloxy)phenyl)isopropylamine | 173908-88-8

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: (4-(benzyloxy)phenyl)isopropylamine
• 英文别名: 4-(Benzyloxy)-N-(propan-2-yl)aniline；4-phenylmethoxy-N-propan-2-ylaniline
• CAS: 173908-88-8
• 化学式: C₁₆H₁₉NO
• 分子量: 241.333
• InChiKey: RDDGPYFWFCIDPK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.6
• 重原子数：
  18
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  21.3
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  溴乙酰溴 、 (4-(benzyloxy)phenyl)isopropylamine 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 生成 N-(4-(benzyloxy)phenyl)-2-bromo-N-isopropylacetamide
  参考文献：
  名称：

  Discovery of 1,5-Benzodiazepines with Peripheral Cholecystokinin (CCK-A) Receptor Agonist Activity. 1. Optimization of the Agonist “Trigger”

  摘要：

  Directed screening of compounds selected from the Glare registry file for contractile activity on the isolated guinea pig gallbladder (GPGB) identified a series of 1,5-benzodiazepines with peripheral cholecystokinin (CCK) receptor agonist activity. Agonist efficacy within this series was modulated by variation of substituents on the N1-anilinoacetamide moiety. Remarkably, a single methyl group confers agonist activity, with an N-isopropyl substituent providing optimal efficacy. Hydrophilic substituents on the anilino nitrogen abolish agonist activity or produce antagonists of CCK. In contrast, hydrophilic electron-donating groups at the para-position of the anilino ring enhance or maintain in vitro and in vivo agonist activity. Despite decreased affinity for the human CCK-A receptor, relative to CCK-8, some of these compounds are equipotent to CCK as anorectic agents in rats following intraperitoneal administration.

  DOI：

  10.1021/jm950626d
• 作为产物：
  描述：

  4-苄氧基苯胺 、 丙酮 在 三乙酰氧基硼氢化钠 作用下， 以 1,2-二氯乙烷 为溶剂， 生成 (4-(benzyloxy)phenyl)isopropylamine
  参考文献：
  名称：

  Discovery of 1,5-Benzodiazepines with Peripheral Cholecystokinin (CCK-A) Receptor Agonist Activity. 1. Optimization of the Agonist “Trigger”

  摘要：

  Directed screening of compounds selected from the Glare registry file for contractile activity on the isolated guinea pig gallbladder (GPGB) identified a series of 1,5-benzodiazepines with peripheral cholecystokinin (CCK) receptor agonist activity. Agonist efficacy within this series was modulated by variation of substituents on the N1-anilinoacetamide moiety. Remarkably, a single methyl group confers agonist activity, with an N-isopropyl substituent providing optimal efficacy. Hydrophilic substituents on the anilino nitrogen abolish agonist activity or produce antagonists of CCK. In contrast, hydrophilic electron-donating groups at the para-position of the anilino ring enhance or maintain in vitro and in vivo agonist activity. Despite decreased affinity for the human CCK-A receptor, relative to CCK-8, some of these compounds are equipotent to CCK as anorectic agents in rats following intraperitoneal administration.

  DOI：

  10.1021/jm950626d

文献信息

• COMPOSITIONS FOR INHIBITION OF INSECT SENSING
  申请人：Zwiebel Laurence

  公开号：US20140242135A1

  公开（公告）日：2014-08-28

  In one aspect, the invention relates to chemical modulators of insect olfactory receptors. In particular, compounds and compositions are provided that can inhibit sensory (e.g., host targeting) functions in airborne insects such as mosquitos. Method of employing such agents, and articles incorporating the same, are also provided. This abstract is intended as a scanning tool for purposes of searching in the particular art and is not intended to be limiting of the present invention.

  在一个方面，本发明涉及昆虫嗅觉受体的化学调节剂。具体地，提供了可以抑制空气传播昆虫（例如蚊子）的感觉（例如宿主定位）功能的化合物和组合物。还提供了使用这些剂的方法以及包含它们的文章。本摘要旨在作为搜索特定领域的扫描工具，不限制本发明。
• HETEROSUBSTITUTED PYRIDINE DERIVATIVES AS PDE 4 INHIBITORS
  申请人：MERCK FROSST CANADA INC.

  公开号：EP1177175A2

  公开（公告）日：2002-02-06
• OXAZINO-QUINAZOLINE AND OXAZINO-QUINAZOLINE TYPE COMPOUND, PREPARATION METHOD THEREFOR, AND USES THEREOF
  申请人：Beijing Scitech-MQ Pharmaceuticals Limited

  公开号：EP3760633B1

  公开（公告）日：2021-12-15
• Compositions for Inhibition of Insect Sensing
  申请人：Vanderbilt University

  公开号：US20170208809A1

  公开（公告）日：2017-07-27

  In one aspect, the invention relates to chemical modulators of insect olfactory receptors. In particular, compounds and compositions are provided that can inhibit sensory (e.g., host targeting) functions in airborne insects such as mosquitoes. Method of employing such agents, and articles incorporating the same, are also provided. This abstract is intended as a scanning tool for purposes of searching in the particular art and is not intended to be limiting of the present invention.
• OXAZINO-QUINAZOLINE AND OXAZINO-QUINOLINE TYPE COMPOUND, PREPARATION METHOD AND USES THEREOF
  申请人：BEIJING SCITECH-MQ PHARMACEUTICALS LIMITED

  公开号：US20210040114A1

  公开（公告）日：2021-02-11

  Provided are an oxazino-quinazoline and oxazino-quinoline type compound, a preparation method, and uses thereof. More particularly provided is a compound shown in formula (I), an isomer, a hydrate, a solvate, a pharmaceutically acceptable salt, a prodrug thereof, a preparation method, and uses thereof in preparing a drug acting as a kinase inhibitor.