3-chloro-2-(4-chlorophenyl)-2H-pyrazolo<3,4-d>thieno<3,2-b>pyridine | 128056-55-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 3-chloro-2-(4-chlorophenyl)-2H-pyrazolo<3,4-d>thieno<3,2-b>pyridine
• 英文别名: 5-Chloro-4-(4-chlorophenyl)-12-thia-3,4,8-triazatricyclo[7.3.0.02,6]dodeca-1(9),2,5,7,10-pentaene
• CAS: 128056-55-3
• 化学式: C₁₄H₇Cl₂N₃S
• 分子量: 320.202
• InChiKey: DXSUEGBXLBXIPI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  20
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  59
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  3-chloro-2-(4-chlorophenyl)-2H-pyrazolo<3,4-d>thieno<3,2-b>pyridine 生成 2-(4-chlorophenyl)-3-methoxy-2H-pyrazolo<3,4-d>thieno<3,2-b>pyridine
  参考文献：
  名称：

  FORBES, IAN T.;JOHNSON, CHRISTOPHER N.;JONES, GRAHAM E.;LOUDON, JULIA;NIC+, J. MED. CHEM., 33,(1990) N, C. 2640-2645

  摘要：

  DOI：
• 作为产物：
  描述：

  在 三氯氧磷 作用下， 以 xylene 为溶剂， 反应 10.0h， 生成 3-chloro-2-(4-chlorophenyl)-2H-pyrazolo<3,4-d>thieno<3,2-b>pyridine
  参考文献：
  名称：

  Synthesis and evaluation of a series of aryl[e]fused pyrazolo[4,3-c]pyridines with potential anxiolytic activity

  摘要：

  A series of pyrazolo[4,3-c]pyridines has been synthesized and evaluated as potential anxiolytic agents. Selected compounds from this series show a pharmacological profile of action different from that of diazepam. A number of the compounds possess higher affinity for central benzodiazepine receptors than diazepam, yet show less anticonvulsant activity and are less sedative. The structure-activity relationships of these potential anxiolytic agents are discussed.

  DOI：

  10.1021/jm00171a046

文献信息

• FORBES, IAN T.;JOHNSON, CHRISTOPHER N.;JONES, GRAHAM E.;LOUDON, JULIA;NIC+, J. MED. CHEM., 33,(1990) N, C. 2640-2645
  作者：FORBES, IAN T.、JOHNSON, CHRISTOPHER N.、JONES, GRAHAM E.、LOUDON, JULIA、NIC+

  DOI：——

  日期：——
• Synthesis and evaluation of a series of aryl[e]fused pyrazolo[4,3-c]pyridines with potential anxiolytic activity
  作者：Ian T. Forbes、Christopher N. Johnson、Graham E. Jones、Julia Loudon、Jane M. Nicholass、Mervyn Thompson、Neil Upton

  DOI：10.1021/jm00171a046

  日期：1990.9

  A series of pyrazolo[4,3-c]pyridines has been synthesized and evaluated as potential anxiolytic agents. Selected compounds from this series show a pharmacological profile of action different from that of diazepam. A number of the compounds possess higher affinity for central benzodiazepine receptors than diazepam, yet show less anticonvulsant activity and are less sedative. The structure-activity relationships of these potential anxiolytic agents are discussed.