1-(4'-fluoro-[1,1'-biphenyl]-2-yl)-2-methylpropan-1-one | 1233011-96-5

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: 1-(4'-fluoro-[1,1'-biphenyl]-2-yl)-2-methylpropan-1-one
• 英文别名: 1-[2-(4-Fluorophenyl)phenyl]-2-methylpropan-1-one
• CAS: 1233011-96-5
• 化学式: C₁₆H₁₅FO
• 分子量: 242.293
• InChiKey: XCZUTBSWXGTLOL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.19
• 拓扑面积：
  17.1
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  1-(4'-fluoro-[1,1'-biphenyl]-2-yl)-2-methylpropan-1-one 在 palladium diacetate 、 三氟乙酸 、 silver(l) oxide 作用下， 反应 15.0h， 以92%的产率得到10,10-dimethyl-2-fluorophenanthrene-9(10H)-one
  参考文献：
  名称：

  Synthesis of Phenanthrone Derivatives from sec-Alkyl Aryl Ketones and Aryl Halides via a Palladium-Catalyzed Dual C−H Bond Activation and Enolate Cyclization

  摘要：

  A palladium-catalyzed chelation-assisted C-H activation of alkyl aryl ketones and their reaction with aryl iodides to afford ortho-arylated products is described. For sec-alkyl aryl ketones, the catalytic reaction proceeds further to give 10,10-dialkylphenanthrone derivatives. A possible reaction mechanism involving directed dual C-H bond activation and enolate cyclization for the formation of 10,10-dialkylphenanthrone derivatives is proposed.

  DOI：

  10.1021/ja1026248

文献信息

• Novel Ethanediamone Hepcidine Antagonists
  申请人：Dürrenberger Franz

  公开号：US20120214798A1

  公开（公告）日：2012-08-23

  The present invention relates to novel hepcidin antagonists of formula (I), pharmaceutical compositions comprising them and the use thereof as medicaments, in particular for treatment of disorders in iron metabolism, such as, in particular, iron deficiency diseases and anaemias, in particular anaemias in connection with chronic inflammatory diseases (ACD: anaemia of chronic disease and AI: anaemia of inflammation).

  本发明涉及一种新型的肝铁蛋白拮抗剂，其化学式为（I），包括它们的药物组合物以及将其用作药物的用途，特别是用于治疗铁代谢紊乱，如特别是铁缺乏病和贫血等疾病，特别是与慢性炎症性疾病相关的贫血（ACD：慢性疾病性贫血和AI：炎症性贫血）。
• [EN] COMPOSITIONS AND METHODS FOR TREATING ESTROGEN-RELATED MEDICAL DISORDERS<br/>[FR] COMPOSITIONS ET PROCÉDÉS PERMETTANT DE TRAITER DES AFFECTIONS MÉDICALES ASSOCIÉES AUX ŒSTROGÈNES
  申请人：UNIV ILLINOIS

  公开号：WO2014066695A1

  公开（公告）日：2014-05-01

  Disclosed is a compound of formula (I). or a pharmaceutically acceptable salt thereof. Also disclosed are pharmaceutical compositions including the compound of formula (I) and methods of using the compound of formula (I).