5,8-dimethyl-3H-quinazolin-4-one | 860192-89-8

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 5,8-dimethyl-3H-quinazolin-4-one
• 英文别名: 5,8-Dimethyl-3H-chinazolin-4-on；5,8-dimethyl-3H-quinazolin-4-one
• CAS: 860192-89-8
• 化学式: C₁₀H₁₀N₂O
• 分子量: 174.202
• InChiKey: YIOPWFKVMNKJGR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.4
• 重原子数：
  13
• 可旋转键数：
  0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  41.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  5,8-dimethyl-3H-quinazolin-4-one 在 氢溴酸 、 sodium methylate 作用下， 生成 3-[3-(3-hydroxy-[2]piperidyl)-2-oxo-propyl]-5,8-dimethyl-3H-quinazolin-4-one
  参考文献：
  名称：

  AN ANTIMALARIAL ALKALOID FROM HYDRANGEA. XV. SYNTHESIS OF 5-, 6-, 7-, AND 8-DERIVATIVES WITH TWO IDENTICAL SUBSTITUENTS

  摘要：

  DOI：

  10.1021/jo01135a015
• 作为产物：
  描述：

  2-氨基-3,6-二甲基苯甲酸 、 formamide 生成 5,8-dimethyl-3H-quinazolin-4-one
  参考文献：
  名称：

  AN ANTIMALARIAL ALKALOID FROM HYDRANGEA. XV. SYNTHESIS OF 5-, 6-, 7-, AND 8-DERIVATIVES WITH TWO IDENTICAL SUBSTITUENTS

  摘要：

  DOI：

  10.1021/jo01135a015

文献信息

• SUBSTITUTED QUINAZOLINE COMPOUNDS AND PREPARATION AND USES THEREOF
  申请人：Sunshine Lake Pharma Co., Ltd.

  公开号：US20180215737A1

  公开（公告）日：2018-08-02

  The present invention relates quinazolinone compounds of Formula (I), as well as their preparation and uses, and further relates pharmaceutical compositions comprising these compounds and their uses; wherein the compounds or pharmaceutical compositions disclosed herein can be used for antagonizing the orexin receptor. The present invention also relates to uses of the compounds or pharmaceutical compositions in treating or preventing neurological and psychiatric disorders and diseases of the central nervous system in mammals, especially in humans.
• AN ANTIMALARIAL ALKALOID FROM HYDRANGEA. XV. SYNTHESIS OF 5-, 6-, 7-, AND 8-DERIVATIVES WITH TWO IDENTICAL SUBSTITUENTS
  作者：B. R. BAKER、ROBERT E. SCHAUB、JOSEPH P. JOSEPH、FRANCIS J. McEVOY、JAMES H. WILLIAMS

  DOI：10.1021/jo01135a015

  日期：1952.1