4-ethyl-4,9-dihydro-benzo[b]thieno[3,4-e][1,4]diazepine-10-thione | 70194-13-7

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 4-ethyl-4,9-dihydro-benzo[b]thieno[3,4-e][1,4]diazepine-10-thione
• 英文别名: 4,9-dihydro-4-ethyl-10H-thieno[3,4-b][1,5]benzodiazepin-10-thione；10-ethyl-5H-thieno[3,4-b][1,5]benzodiazepine-4-thione
• CAS: 70194-13-7
• 化学式: C₁₃H₁₂N₂S₂
• 分子量: 260.384
• InChiKey: WBJDPSBSJHZBLK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  17
• 可旋转键数：
  1
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  75.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-ethyl-4,9-dihydro-benzo[b]thieno[3,4-e][1,4]diazepine-10-thione 在 氢氧化钾 作用下， 以 1,4-二氧六环 、 甲醇 为溶剂， 生成 4-ethyl-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：

  4,9-Dihydro-4-ethyl-10H-thieno[3,4-b][1,5]benzodiazepin-10-one 在 tetraphosphorus decasulfide 作用下， 以 吡啶 为溶剂， 生成 4-ethyl-4,9-dihydro-benzo[b]thieno[3,4-e][1,4]diazepine-10-thione
  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

文献信息

• 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
  作者：PRESS J. B.、 HOFMANN C. M.、 EUDY N. H.、 FANSHAWE W. J.、 DAY I. P.、 GREENB+

  DOI：——

  日期：——
• US4087421A
  申请人：——

  公开号：US4087421A

  公开（公告）日：1978-05-02