2-[(5-Methyl-2-nitrophenyl)acetyl]cyclopentanone | 247145-29-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-[(5-Methyl-2-nitrophenyl)acetyl]cyclopentanone
• CAS: 247145-29-5
• 化学式: C₁₄H₁₅NO₄
• 分子量: 261.277
• InChiKey: GUYMDPDXRRPVNW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.38
• 重原子数：
  19.0
• 可旋转键数：
  4.0
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  77.28
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  2-[(5-Methyl-2-nitrophenyl)acetyl]cyclopentanone 在 盐酸 、 氢氧化钾 、 lithium aluminium tetrahydride 、 sodium azide 、 PPA 、 硫酸 、 N-乙基二环己胺 、 tin(ll) chloride 作用下， 以 四氢呋喃 、 甲醇 、 乙醚 、 氯仿 、 苯 为溶剂， 反应 77.0h， 生成 9-Methyl-1,2,3,4,6,7,12,12b-octahydro-7-oxoindolo[2,3-a]quinolizine
  参考文献：
  名称：

  Synthesis and pharmacological investigation of 9-methyl-1,2,3,4,6,7,12,12b-octahydro-7-oxo-indolo[2,3-a]quinolizine

  摘要：

  The title ketone, a supposed metabolite of 9-methyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine (MIQ), was prepared and found different on chromatographic comparison from the isolated metabolite M-4. However, the pharmacological screening of this compound evidenced, among others, some interesting properties as inhibition of arachidonic acid induced platelet aggregation and protection from both hypobaric and cyanide induced hypoxia in mice. These activities suggest a possible cerebroprotective action to be further investigated. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(99)00056-7
• 作为产物：
  描述：

  5-甲基-2-硝基苯乙酸 在 氯化亚砜 、 三乙胺 作用下， 以 氯仿 、 N,N-二甲基甲酰胺 为溶剂， 反应 6.0h， 生成 2-[(5-Methyl-2-nitrophenyl)acetyl]cyclopentanone
  参考文献：
  名称：

  Synthesis and pharmacological investigation of 9-methyl-1,2,3,4,6,7,12,12b-octahydro-7-oxo-indolo[2,3-a]quinolizine

  摘要：

  The title ketone, a supposed metabolite of 9-methyl-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizine (MIQ), was prepared and found different on chromatographic comparison from the isolated metabolite M-4. However, the pharmacological screening of this compound evidenced, among others, some interesting properties as inhibition of arachidonic acid induced platelet aggregation and protection from both hypobaric and cyanide induced hypoxia in mice. These activities suggest a possible cerebroprotective action to be further investigated. (C) 1999 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(99)00056-7