脱氟奈必洛尔 | 129101-34-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 中文名称: 脱氟奈必洛尔
• 中文别名: 奈比洛尔杂质
• 英文名称: Defluoro Nebivolol
• 英文别名: 2-[[2-(3,4-dihydro-2H-chromen-2-yl)-2-hydroxyethyl]amino]-1-(6-fluoro-3,4-dihydro-2H-chromen-2-yl)ethanol
• CAS: 129101-34-4
• 化学式: C₂₂H₂₆FNO₄
• 分子量: 387.4
• InChiKey: JMAVJQLYDMPPMQ-UHFFFAOYSA-N

物化性质

• 沸点：
  598.0±50.0 °C(Predicted)
• 密度：
  1.268±0.06 g/cm3(Predicted)
• 溶解度：
  可溶于DMSO（少许）、甲醇（少许）

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  28
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  71
• 氢给体数：
  3
• 氢受体数：
  6

文献信息

• PREPARATION OF NEBIVOLOL
  申请人：Haldar Pranab

  公开号：US20110250454A1

  公开（公告）日：2011-10-13

  Processes for the synthesis of pharmacologically active 2,2-iminobisethanol derivatives, e.g., 2H-1-benzopyran-2 methanol-α,α′-iminobis(methylene)]bis-[6-fluoro-3,4-dihydro-[2R*[R*[R*(S*)]]]], and their pharmaceutically acceptable salts.

  合成具有药理活性的2,2-亚氨基双乙醇衍生物的过程，例如2H-1-苯并吡喁-2-甲醇-α，α′-亚氨基双(亚甲基)]]双-[6-氟-3,4-二氢-[2R*[R*[R*(S*)]]]]，以及它们的药用可接受盐。
• [EN] PROCESS FOR PREPARING NEBIVOLOL<br/>[FR] PROCÉDÉ POUR LA PRÉPARATION DE NÉBIVOLOL
  申请人：ZACH SYSTEM SPA

  公开号：WO2010049455A1

  公开（公告）日：2010-05-06

  The present invention relates to a process for preparing Nebivolol and, more particularly, to an improved method of debenzylation of a compound of formula (II) useful for preparing nebivolol endowed with high purity.

  本发明涉及一种制备尼比洛尔的方法，更具体地说，涉及一种改进的去苄基化方法，用于制备具有高纯度的尼比洛尔的化合物（II）的方法。
• PROCESS FOR PREPARING NEBIVOLOL
  申请人：Maragni Paolo

  公开号：US20110207948A1

  公开（公告）日：2011-08-25

  The present invention relates to a process for preparing Nebivolol and, more particularly, to an improved method of debenzylation of a compound of formula (II) useful for preparing nebivolol endowed with high purity.

  本发明涉及一种制备奈必洛尔的方法，更具体地说，涉及一种改进的去苄基化方法，用于制备高纯度的奈必洛尔。
• US8927742B2
  申请人：——

  公开号：US8927742B2

  公开（公告）日：2015-01-06
• [EN] IMPROVED PROCESS FOR THE PREPARATION OF NEBIVOLOL HYDROCHLORIDE<br/>[FR] PROCÉDÉ AMÉLIORÉ D'ÉLABORATION D'HYDROCHLORURE DE NÉBIVOLOL
  申请人：MSN LAB LTD

  公开号：WO2010089764A2

  公开（公告）日：2010-08-12

  An improved process for the preparation of nebivolol and its pharmaceutically acceptable salts is disclosed Concretely, the process involves a) esterifying 6-fluoro-3,4-dihydro-2H-l-benzopyran-2-carboxylic acid to provide alkyl 6-fluoro-3,4-dihydro-2H-l-benzopyran-2-carboxylate, b) reducing the alkyl 6-fluoro-3,4-dihydro-2H-l-benzopyran-2-carboxylate to provide 6-fluoro-3,4-dihydro-2H-l-benzopyran-2-carboxaldehyde, which is subsequently converted to 6-fluoro-3,4-dihydro-2-oxiranyl-2H-l-benzopyran, c) reacting 6-fluoro-3,4-dihydro-2-oxiranyl-2H-l-benzopyran with benzyl amine in a suitable solvent followed by treatment with suitable organic acid, and recrystalhzing the obtained compound to provide the corresponding organic acid salt of benzyl protected nebivolol, d) debenzylating the benzyl protected nebivolol salt, followed by treatment with hydrochloric acid to provide nebivolol hydrochloride