ethyl 7-(2-(4-chlorophenyl)hydrazino)-5-phenylthieno<3,2,-b>pyridine-6-carboxylate monohydrochloride | 96516-79-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: ethyl 7-(2-(4-chlorophenyl)hydrazino)-5-phenylthieno<3,2,-b>pyridine-6-carboxylate monohydrochloride
• 英文别名: ethyl 7-[2-(4-chlorophenyl)hydrazinyl]-5-phenylthieno[3,2-b]pyridine-6-carboxylate;hydrochloride
• CAS: 96516-79-9
• 化学式: C₂₂H₁₈ClN₃O₂S*ClH
• 分子量: 460.384
• InChiKey: BXJFGQBYUPBFEC-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.65
• 重原子数：
  30.0
• 可旋转键数：
  6.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.09
• 拓扑面积：
  63.25
• 氢给体数：
  2.0
• 氢受体数：
  6.0

反应信息

• 作为反应物：
  描述：

  ethyl 7-(2-(4-chlorophenyl)hydrazino)-5-phenylthieno<3,2,-b>pyridine-6-carboxylate monohydrochloride 在 potassium carbonate 作用下， 以 仲丁醇 为溶剂， 反应 20.0h， 以60%的产率得到2-(4-Chloro-phenyl)-4-phenyl-2,5-dihydro-pyrazolo[3,4-d]thieno[3,2-b]pyridin-3-one
  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
• 作为产物：
  描述：

  ethyl 4,7-dihydro-7-oxo-5-phenylthieno<3,2-b>pyridine-6-carboxylate 在 三氯氧磷 作用下， 以 乙醇 为溶剂， 反应 18.0h， 生成 ethyl 7-(2-(4-chlorophenyl)hydrazino)-5-phenylthieno<3,2,-b>pyridine-6-carboxylate monohydrochloride
  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：——