2-氯-7-甲氧基-3-苯基喹啉 | 85274-56-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 中文名称: 2-氯-7-甲氧基-3-苯基喹啉
• 英文名称: 2-chloro-7-methoxy-3-phenylquinoline
• CAS: 85274-56-2
• 化学式: C₁₆H₁₂ClNO
• 分子量: 269.73
• InChiKey: BWUOBDNTWOCUFS-UHFFFAOYSA-N

物化性质

• 熔点：
  126-128 °C
• 沸点：
  400.6±40.0 °C(Predicted)
• 密度：
  1.237±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  4.7
• 重原子数：
  19
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  22.1
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  2933499090

反应信息

• 作为反应物：
  描述：

  2-氯-7-甲氧基-3-苯基喹啉 以 硝基苯 、 乙腈 、 三氟乙酸 为溶剂， 反应 6.5h， 生成 ethyl 8-methoxy-2-methyl-4-phenylimidazo<1,2-a>quinoline-1-carboxylate
  参考文献：
  名称：

  Prager, Rolf H.; Singh, Yogendra; Weber, Ben, Australian Journal of Chemistry, 1994, vol. 47, # 7, p. 1249 - 1262

  摘要：

  DOI：
• 作为产物：
  描述：

  N-(3-methoxyphenyl)-2-phenylacetamide 、 Vilsmeier reagent 在 三氯氧磷 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 2-氯-7-甲氧基-3-苯基喹啉
  参考文献：
  名称：

  Synthesis and 5-hydroxytryptamine antagonist activity of 2-[[2-(dimethylamino)ethyl]thio]-3-phenylquinoline and its analogs

  摘要：

  A series of 2-[(2-aminoethyl)thio]quinolines substituted at the 3-position with alkyl, aryl, or heteroaryl groups has been prepared in the search for novel and selective 5-HT2 antagonists. The affinity of the compounds for 5-HT1 receptor sites was measured by their ability to displace [3H]-5-HT from rat brain synaptosomes whereas the affinity for 5-HT2 receptor sites was measured by their ability to displace [3H]spiperone from synaptosomes prepared from rat brain cortex. The 5-HT2 antagonist properties of the compounds were measured in vivo by their antagonism of 5-hydroxytryptophan-induced head twitches in the mouse and by their antagonism of hyperthermia induced by fenfluramine (N-ethyl-alpha-methyl-m-(trifluoromethyl)phenethylamine hydrochloride) in the rat. The structure-activity relationships in this series are discussed and the properties of 2-[[2-(dimethylamino)ethyl]thio]-3-phenylquinoline hydrochloride (70) are highlighted.

  DOI：

  10.1021/jm00395a013

文献信息

• Prager Rolf H., Singh Yogendra, Weber Ben, Austral. J. Chem, 47 (1994) N 7, S 1249-1262
  作者：Prager Rolf H., Singh Yogendra, Weber Ben

  DOI：——

  日期：——
• BLACKBURN, THOMAS P.;COX, BARRY;GUILDFORD, ALLEN J.;LE, COUNT DAVID J.;MI+, J. MED. CHEM., 30,(1987) N 12, 2252-2259
  作者：BLACKBURN, THOMAS P.、COX, BARRY、GUILDFORD, ALLEN J.、LE, COUNT DAVID J.、MI+

  DOI：——

  日期：——
• SUBSTITUTED BICYCLIC BIS-ARYL COMPOUNDS EXHIBITING SELECTIVE LEUKOTRIENE B 4? ANTAGONIST ACTIVITY, THEIR PREPARATION AND USE IN PHARMACEUTICAL COMPOSITIONS
  申请人：RHONE-POULENC RORER S.A.

  公开号：EP0540604A1

  公开（公告）日：1993-05-12
• US5366982A
  申请人：——

  公开号：US5366982A

  公开（公告）日：1994-11-22
• US5492915A
  申请人：——

  公开号：US5492915A

  公开（公告）日：1996-02-20