2-indanone thiosemicarbazone | 60798-85-8

• 分子结构分类: 有机化合物 - 苯类化合物 - 茚满类
• 英文名称: 2-indanone thiosemicarbazone
• 英文别名: FM00222；(1,3-Dihydroinden-2-ylideneamino)thiourea
• CAS: 60798-85-8
• 化学式: C₁₀H₁₁N₃S
• mdl: MFCD00463362
• 分子量: 205.283
• InChiKey: JGHCFRSOVBJGGA-UHFFFAOYSA-N

物化性质

• 熔点：
  202 °C(Solv: ethanol (64-17-5))
• 沸点：
  374.5±52.0 °C(Predicted)
• 密度：
  1.35±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.1
• 重原子数：
  14
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  82.5
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  氨基硫脲 、 2-茚酮 在 溶剂黄146 作用下， 以 乙醇 为溶剂， 反应 24.0h， 生成 2-indanone thiosemicarbazone
  参考文献：
  名称：

  Evaluation of the semicarbazones, thiosemicarbazones and bis-carbohydrazones of some aryl alicycylic ketones for anticonvulsant and other biological propertie

  摘要：

  A number of aryl alicyclic ketones were converted to their corresponding semicarbazones, thiosemicarbazones and bis-carbohydrazones. Anticonvulsant activity was displayed by most of the compounds in the maximal electroshock (MES) and subcutaneous pentylenetetrazole (scPTZ) screens when given intraperitoneally to mice. However, on oral administration to rats, a marked selective activity in the MES screen only was noted. X-ray crystallography on five semicarbazones was undertaken in order to find correlations between the shapes of these molecules and anticonvulsant properties. The thiosemicarbazones displayed greater cytotoxicity to P388D1 and L1210 cells than the semicarbazones while a number of human tumors and different viruses were, in general, insensitive to representative compounds.

  DOI：

  10.1016/0223-5234(96)88238-9

文献信息

• Tomchin, A. B.; Marysheva, V. V., Journal of Organic Chemistry USSR (English Translation), 1988, vol. 24, p. 1648 - 1654
  作者：Tomchin, A. B.、Marysheva, V. V.

  DOI：——

  日期：——
• TOMCHIN, A. B.;MARYSHEVA, V. V., ZH. ORGAN. XIMII, 24,(1988) N 9, S. 1827-1835
  作者：TOMCHIN, A. B.、MARYSHEVA, V. V.

  DOI：——

  日期：——
• Evaluation of the semicarbazones, thiosemicarbazones and bis-carbohydrazones of some aryl alicycylic ketones for anticonvulsant and other biological propertie
  作者：JR Dimmock、SN Pandeya、JW Quail、U Pugazhenthi、TM Allen、GY Kao、J Balzarini、E DeClercq

  DOI：10.1016/0223-5234(96)88238-9

  日期：——

  A number of aryl alicyclic ketones were converted to their corresponding semicarbazones, thiosemicarbazones and bis-carbohydrazones. Anticonvulsant activity was displayed by most of the compounds in the maximal electroshock (MES) and subcutaneous pentylenetetrazole (scPTZ) screens when given intraperitoneally to mice. However, on oral administration to rats, a marked selective activity in the MES screen only was noted. X-ray crystallography on five semicarbazones was undertaken in order to find correlations between the shapes of these molecules and anticonvulsant properties. The thiosemicarbazones displayed greater cytotoxicity to P388D1 and L1210 cells than the semicarbazones while a number of human tumors and different viruses were, in general, insensitive to representative compounds.