3,7-bis(dimethylamino)oxazinium chloride

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并恶嗪类
• 英文名称: 3,7-bis(dimethylamino)oxazinium chloride
• 英文别名: 3,7-bis(N,N-dimethylamino)phenoxazinium perchlorate；[7-(dimethylamino)phenoxazin-3-ylidene]-dimethylazanium;perchlorate
• 化学式: C₁₆H₁₈N₃O*ClO₄
• 分子量: 367.789
• InChiKey: LNBULUIHZQNYID-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -2.73
• 重原子数：
  25
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  102
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  N,N-二甲基-4-亚硝基苯胺 、 3-羟基-N,N-二甲基苯胺 在 高氯酸 、 air 作用下， 以 乙醇 为溶剂， 以40%的产率得到3,7-bis(dimethylamino)oxazinium chloride
  参考文献：
  名称：

  Synthesis and Antimalarial Property of Orally Active Phenoxazinium Salts

  摘要：

  Phenoxazinium salts were found to display good antimalarial efficacy in vivo against Plasmodium berghei. Several compounds provided 100% parasitemia clearance at a dose of 20-30 mg kg(-1) x 4 days (ip) and good survival effects without obvious acute toxicity. They also showed excellent potency by oral administration. A preliminary pharmacokinetic study revealed that the oral availability of 1a was excellent.

  DOI：

  10.1021/jm070201e

文献信息

• [EN] 3,6-DISUBSTITUTED XANTHYLIUM SALTS<br/>[FR] SELS DE XANTHYLIUM DISUBSTITUÉS EN 3 ET 6
  申请人：WISTA LAB LTD

  公开号：WO2010067078A8

  公开（公告）日：2010-09-02
• Synthesis and Antimalarial Property of Orally Active Phenoxazinium Salts
  作者：Kiyosei Takasu、Tsubasa Shimogama、Chie Satoh、Marcel Kaiser、Reto Brun、Masataka Ihara

  DOI：10.1021/jm070201e

  日期：2007.5.1

  Phenoxazinium salts were found to display good antimalarial efficacy in vivo against Plasmodium berghei. Several compounds provided 100% parasitemia clearance at a dose of 20-30 mg kg(-1) x 4 days (ip) and good survival effects without obvious acute toxicity. They also showed excellent potency by oral administration. A preliminary pharmacokinetic study revealed that the oral availability of 1a was excellent.