(2Z)-2-(9-fluoro-2,2,4-trimethyl-1H-chromeno[3,4-f]quinolin-5-ylidene)acetaldehyde | 593288-76-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: (2Z)-2-(9-fluoro-2,2,4-trimethyl-1H-chromeno[3,4-f]quinolin-5-ylidene)acetaldehyde
• CAS: 593288-76-7
• 化学式: C₂₁H₁₈FNO₂
• 分子量: 335.378
• InChiKey: DWRXZZOJNRAGLX-LSCVHKIXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.8
• 重原子数：
  25
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  38.3
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  (2Z)-2-(9-fluoro-2,2,4-trimethyl-1H-chromeno[3,4-f]quinolin-5-ylidene)acetaldehyde 在 对甲苯磺酸 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 生成 9-Fluoro-2,2,4-trimethyl-5-((Z)-3-methyl-but-2-enylidene)-2,5-dihydro-1H-6-oxa-1-aza-chrysene
  参考文献：
  名称：

  Synthesis and biological activity of 5-methylidene 1,2-dihydrochromeno[3,4-f]quinoline derivatives as progesterone receptor modulators

  摘要：

  A series of 5-methylidene 1,2-dihydrochromeno[3,4-]quinoline derivatives were synthesized and tested in biological assays to evaluate scope and limitations of the nonsteroidal SPRM pharmacophore (3). A number of orally available highly potent nonsteroidal modulators were identified by modification of the substituents at 5-methylidene position. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00255-5
• 作为产物：
  描述：

  (Z)-2-(9-fluoro-2,2,4-trimethyl-1,2-dihydrochromeno[3,4-f]quinolin-5-ylidene)acetonitrile 在 二异丁基氢化铝 作用下， 以 乙醚 为溶剂， 生成 (2Z)-2-(9-fluoro-2,2,4-trimethyl-1H-chromeno[3,4-f]quinolin-5-ylidene)acetaldehyde
  参考文献：
  名称：

  Synthesis and biological activity of 5-methylidene 1,2-dihydrochromeno[3,4-f]quinoline derivatives as progesterone receptor modulators

  摘要：

  A series of 5-methylidene 1,2-dihydrochromeno[3,4-]quinoline derivatives were synthesized and tested in biological assays to evaluate scope and limitations of the nonsteroidal SPRM pharmacophore (3). A number of orally available highly potent nonsteroidal modulators were identified by modification of the substituents at 5-methylidene position. (C) 2003 Elsevier Science Ltd. All rights reserved.

  DOI：

  10.1016/s0960-894x(03)00255-5