6-methyl-4,9-dihydro-benzo[b]thieno[3,4-e][1,4]diazepin-10-one | 70194-12-6

• 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: 6-methyl-4,9-dihydro-benzo[b]thieno[3,4-e][1,4]diazepin-10-one
• 英文别名: 8-methyl-5,10-dihydrothieno[3,4-b][1,5]benzodiazepin-4-one
• CAS: 70194-12-6
• 化学式: C₁₂H₁₀N₂OS
• 分子量: 230.29
• InChiKey: FTLUYGLUNVZNSX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  16
• 可旋转键数：
  0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  69.4
• 氢给体数：
  2
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  6-methyl-4,9-dihydro-benzo[b]thieno[3,4-e][1,4]diazepin-10-one 、 N-甲基哌嗪 在 四氯化钛 苯甲醚 作用下， 以 甲苯 为溶剂， 生成 6-methyl-10-(4-methyl-piperazin-1-yl)-4H-benzo[b]thieno[3,4-e][1,4]diazepine
  参考文献：
  名称：

  10-(Alkylamino)-4H-thieno[3,4-b][1,5]benzodiazepines. A novel class of potential neuroleptic agents

  摘要：

  An investigation of the structural requirements for CNS activity of the title compounds was undertaken. A synthesis of the precursor dihydro-10H-thieno[3,4-b][1,5]benzodiazepin-10-ones was achieved and three routes for their conversion to the title compounds were developed. The compounds were tested for neuroleptic activity by means of the blockade or d-amphetamine lethality in aggregated mice and/or effects on locomotor activity in rats. Antidepressant activity was examined using inhibition of tetrabenazine-induced depression in mice. Most of the compounds were found to be potent neuroleptic agents with several exhibiting additional antidepressant activity.

  DOI：

  10.1021/jm00192a020
• 作为产物：
  描述：

  7-methyl-1,3,5,10-tetrahydrothieno[3,4-c][1,5]benzodiazepin-4-one 以35%的产率得到
  参考文献：
  名称：

  PRESS J. B.; HOFMANN C. M.; EUDY N. H.; FANSHAWE W. J.; DAY I. P.; GREENB+, J. MED. CHEM., 1979, 22, NO 6, 725-731

  摘要：

  DOI：