3-(二甲氨基)-1-(4-苯基苯基)丙烷-1-酮 | 105398-43-4

• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: 3-(二甲氨基)-1-(4-苯基苯基)丙烷-1-酮
• 英文名称: dimethylamino-3-(bipenyl-4)-1-propane-1
• 英文别名: 1-biphenyl-4-yl-3-dimethylamino-propan-1-one；1-Biphenyl-4-yl-3-dimethylamino-propan-1-on；β-N.N-Dimethylamino-4-phenyl-propiophenon；4-(β-Dimethylamino-propionyl)-biphenyl；4-(3-Dimethylamino-propionyl)-biphenyl；1-Propanone, 1-[1,1'-biphenyl]-4-yl-3-(dimethylamino)-；3-(dimethylamino)-1-(4-phenylphenyl)propan-1-one
• CAS: 105398-43-4
• 化学式: C₁₇H₁₉NO
• 分子量: 253.344
• InChiKey: LHERWDZHGZFVEV-UHFFFAOYSA-N

物化性质

• 熔点：
  77-78 °C(Solv: ethanol (64-17-5))
• 沸点：
  390.8±25.0 °C(Predicted)
• 密度：
  1.042±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  19
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  20.3
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  3-(二甲氨基)-1-(4-苯基苯基)丙烷-1-酮 以 四氢呋喃 、 正己烷 为溶剂， 反应 1.0h， 生成 1,3-Dimethyl-3-(4'biphenylyl)pyrrolidine
  参考文献：
  名称：

  Photocyclization of 4-(dialkylamino)-2-aryl-1-butenes

  摘要：

  Irradiation of 4-(dialkylamino)-2-aryl-1-butenes gave cyclization products, 3-methyl-3-arylpyrrolidines, in high yields. These styrylamines formed fluorescent intramolecular exciplexes, but studies based on Stern-Volmer quenching for the fluorescence and the photoreaction suggested that the emissive exciplexes did not participate in the photoreaction.

  DOI：

  10.1021/jo00037a017
• 作为产物：
  描述：

  联苯单乙酮 、 聚合甲醛 、 盐酸二甲胺 在 盐酸 作用下， 生成 3-(二甲氨基)-1-(4-苯基苯基)丙烷-1-酮
  参考文献：
  名称：

  Nobles; Burckhalter, Journal of the American Pharmaceutical Association (1912), 1958, vol. 47, p. 77,80

  摘要：

  DOI：

文献信息

• Optimization of isochromanone based urotensin II receptor agonists
  作者：Fredrik Lehmann、Erika A. Currier、Roger Olsson、Jian-Nong Ma、Ethan S. Burstein、Uli Hacksell、Kristina Luthman

  DOI：10.1016/j.bmc.2010.04.041

  日期：2010.7

  A series of novel isochromanone based urotensin II receptor agonists have been synthesized and evaluated for their activity using a functional cell based assay (R-SAT). Several potent and efficacious derivatives were identified with 3-(3,4-dichlorophenyl)-6,7-dimethyl-3-(2-dimethylaminoethyl) isochroman-1-one (28) being the most potent compound showing an EC50-value of 51 nM, thereby being the most potent compound so far within the isochromanone series. In addition, two other heterocyclic systems (isochromanes and tetrahydroisoquinolinones) were investigated and these derivatives were found to be both potent and efficacious. The activity of the isochromane derivatives implies that the carbonyl group of the isochromanone is not necessary for activity. Furthermore it was found that the geometry of the heterocycles was more important for receptor interaction than the composition of the heteroatoms present. (C) 2010 Elsevier Ltd. All rights reserved.
• Phillips, Richard B.; Herbert, Sue A.; Robichaud, Albert J., Synthetic Communications, 1986, vol. 16, # 4, p. 411 - 418
  作者：Phillips, Richard B.、Herbert, Sue A.、Robichaud, Albert J.

  DOI：——

  日期：——
• Thiault; Le Guen; Walrant, Farmaco, Edizione Scientifica, 1984, vol. 39, # 6, p. 524 - 537
  作者：Thiault、Le Guen、Walrant、Boucherle

  DOI：——

  日期：——
• Mann; Back; Mutschler, Archiv der Pharmazie, 1973, vol. 306, # 8, p. 625 - 631
  作者：Mann、Back、Mutschler

  DOI：——

  日期：——
• Synthesis of Nicotine Analogs¹
  作者：J. H. BURCKHALTER、J. H. SHORT

  DOI：10.1021/jo01103a012

  日期：1958.9