1-{4-[2-(4,4-Difluoro-piperidin-1-yl)-6,7-dihydro-5H-cyclopentapyrimidin-4-ylamino]-phenyl}cyclobutanecarboxylic acid methyl ester | 1215018-04-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 1-{4-[2-(4,4-Difluoro-piperidin-1-yl)-6,7-dihydro-5H-cyclopentapyrimidin-4-ylamino]-phenyl}cyclobutanecarboxylic acid methyl ester
• 英文别名: methyl 1-[4-[[2-(4,4-difluoropiperidin-1-yl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl]amino]phenyl]cyclobutane-1-carboxylate
• CAS: 1215018-04-4
• 化学式: C₂₄H₂₈F₂N₄O₂
• 分子量: 442.509
• InChiKey: AIKYDTDXOAYWLV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  32
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  67.4
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  1-[4-(2-chloro-6,7-dihydro-5H-cyclopentapyrimidin-4-ylamino)-phenyl]-cyclobutanecarboxylic acid methyl ester 、 4,4-二氟哌啶盐酸盐 在 N,N-二异丙基乙胺 作用下， 以 异丙醇 为溶剂， 反应 48.0h， 以77%的产率得到1-{4-[2-(4,4-Difluoro-piperidin-1-yl)-6,7-dihydro-5H-cyclopentapyrimidin-4-ylamino]-phenyl}cyclobutanecarboxylic acid methyl ester
  参考文献：
  名称：

  Novel Biccyclic Compounds As GATA Modulators

  摘要：

  提供了新型双环化合物、立体异构体和/或新型双环化合物的药用可接受盐，以及新型双环化合物的立体异构体的药用可接受盐。此外，还提供了形成新型双环化合物、立体异构体和/或新型双环化合物的药用可接受盐，以及新型双环化合物的立体异构体的药用可接受盐的方法。

  公开号：

  US20100144731A1

文献信息

• Biccyclic compounds as GATA modulators
  申请人：Dr. Reddy's Laboratories Limited

  公开号：US07989463B2

  公开（公告）日：2011-08-02

  Novel bicyclic compounds of the formula (I), stereoisomers, and/or pharmaceutically acceptable salts of the novel bicyclic compounds, and/or pharmaceutically acceptable salts of the stereoisomers of the novel bicyclic compounds are provided. Additionally, methods of forming novel bicyclic compounds, stereoisomers, and/or pharmaceutically acceptable salts of the novel bicyclic compounds, and/or pharmaceutically acceptable salts of the stereoisomers of the novel bicyclic compounds are provided: wherein R1, R2, m, and n are defined herein.

  本发明提供了式(I)的新型双环化合物、立体异构体和/或其药学上可接受的盐，以及新型双环化合物立体异构体和/或其药学上可接受的盐的药学上可接受的盐。此外，本发明还提供了制备新型双环化合物、立体异构体和/或其药学上可接受的盐，以及新型双环化合物立体异构体和/或其药学上可接受的盐的方法。其中，R1、R2、m和n如本文所定义。
• US7989463B2
  申请人：——

  公开号：US7989463B2

  公开（公告）日：2011-08-02
• [EN] NOVEL BICCYCLIC COMPOUNDS AS GATA MODULATORS<br/>[FR] NOUVEAUX COMPOSÉS BICYCLIQUES COMME MODULATEURS DE GATA
  申请人：REDDYS LAB LTD DR

  公开号：WO2010028174A1

  公开（公告）日：2010-03-11

  Novel bicyclic compounds, stereoisomers, and/or pharmaceutically acceptable salts of the novel bicyclic compounds, and/or pharmaceutically acceptable salts of the stereoisomers of the novel bicyclic compounds are provided. Additionally, methods of forming novel bicyclic compounds, stereoisomers, and/or pharmaceutically acceptable salts of the novel bicyclic compounds, and/or pharmaceutically acceptable salts of the stereoisomers of the novel bicyclic compounds are provided.
• Novel Biccyclic Compounds As GATA Modulators
  申请人：De Dibyendu

  公开号：US20100144731A1

  公开（公告）日：2010-06-10

  Novel bicyclic compounds, stereoisomers, and/or pharmaceutically acceptable salts of the novel bicyclic compounds, and/or pharmaceutically acceptable salts of the stereoisomers of the novel bicyclic compounds are provided. Additionally, methods of forming novel bicyclic compounds, stereoisomers, and/or pharmaceutically acceptable salts of the novel bicyclic compounds, and/or pharmaceutically acceptable salts of the stereoisomers of the novel bicyclic compounds are provided.

  提供了新型双环化合物、立体异构体和/或新型双环化合物的药用可接受盐，以及新型双环化合物的立体异构体的药用可接受盐。此外，还提供了形成新型双环化合物、立体异构体和/或新型双环化合物的药用可接受盐，以及新型双环化合物的立体异构体的药用可接受盐的方法。