7-methoxy-olanzapine | 186792-81-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯二氮卓类
• 英文名称: 7-methoxy-olanzapine
• CAS: 186792-81-4
• 化学式: C₁₈H₂₂N₄OS
• 分子量: 342.465
• InChiKey: CZHJYRYMCRMRCL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.45
• 重原子数：
  24.0
• 可旋转键数：
  1.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.39
• 拓扑面积：
  40.1
• 氢给体数：
  1.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  7-methoxy-olanzapine 在 间氯过氧苯甲酸 作用下， 以 二氯甲烷 为溶剂， 生成 7-Methoxy-2-methyl-10-(4-methyl-4-oxy-piperazin-1-yl)-4H-3-thia-4,9-diaza-benzo[f]azulene
  参考文献：
  名称：

  The synthesis and biological activity of some known and putative metabolites of the atypical antipsychotic agent olanzapine (LY170053)

  摘要：

  4'-N-desmethyl olanzapine (2), olanzapine 4'-N-oxide (3) and 2-hydroxymethyl olanzapine (5), have been prepared and their pharmacology compared to that of the parent compound olanzapine (1). The 4'-N-quaternary glucuronide (8) has also been prepared. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0960-894x(96)00567-7
• 作为产物：
  描述：

  2-氨基-3-氰基-5-甲基噻吩 在 lithium hydroxide 、 tin(ll) chloride 作用下， 以 乙醇 、 二甲基亚砜 、 甲苯 为溶剂， 生成 7-methoxy-olanzapine
  参考文献：
  名称：

  The synthesis and biological activity of some known and putative metabolites of the atypical antipsychotic agent olanzapine (LY170053)

  摘要：

  4'-N-desmethyl olanzapine (2), olanzapine 4'-N-oxide (3) and 2-hydroxymethyl olanzapine (5), have been prepared and their pharmacology compared to that of the parent compound olanzapine (1). The 4'-N-quaternary glucuronide (8) has also been prepared. Copyright (C) 1996 Elsevier Science Ltd

  DOI：

  10.1016/s0960-894x(96)00567-7

文献信息

• The synthesis and biological activity of some known and putative metabolites of the atypical antipsychotic agent olanzapine (LY170053)
  作者：David O Calligaro、John Fairhurst、Terrence M Hotten、Nicholas A Moore、David E Tupper

  DOI：10.1016/s0960-894x(96)00567-7

  日期：1997.1

  4'-N-desmethyl olanzapine (2), olanzapine 4'-N-oxide (3) and 2-hydroxymethyl olanzapine (5), have been prepared and their pharmacology compared to that of the parent compound olanzapine (1). The 4'-N-quaternary glucuronide (8) has also been prepared. Copyright (C) 1996 Elsevier Science Ltd