1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidohydrazide | 1344670-06-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡唑并吡啶类
• 英文名称: 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidohydrazide
• 英文别名: N'-amino-1-[(2-fluorophenyl)methyl]pyrazolo[3,4-b]pyridine-3-carboximidamide
• CAS: 1344670-06-9
• 化学式: C₁₄H₁₃FN₆
• 分子量: 284.296
• InChiKey: XWNYUWKYRSXKGN-UHFFFAOYSA-N

物化性质

• 沸点：
  483.5±55.0 °C(Predicted)
• 密度：
  1.46±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  1.7
• 重原子数：
  21
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  95.1
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidohydrazide 在 sodium periodate 、 ruthenium(III) trichloride hydrate 、 氨 、 三氯氧磷 作用下， 以 1,4-二氧六环 、 乙醇 、 水 、 乙腈 为溶剂， 生成 {3-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]-7-methyl-6-oxo-6,7-dihydro-5H-pyrrolo[2,3-e][1,2,4]triazin-7-yl}acetic acid
  参考文献：
  名称：

  SUBSTITUTED ANNULATED PYRIMIDINES AND TRIAZINES, AND USE THEREOF

  摘要：

  本申请涉及新颖的取代融合嘧啶和三嗪化合物，以及它们的制备方法，单独或组合用于治疗和/或预防疾病，以及用于生产药物治疗和/或预防疾病，特别是用于治疗和/或预防心血管疾病。

  公开号：

  US20140357637A1
• 作为产物：
  描述：

  1-(2-氟苄基)-1H-吡唑并[3,4-b]吡啶-3-甲腈 在 一水合肼 作用下， 以 甲醇 为溶剂， 生成 1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridine-3-carboximidohydrazide
  参考文献：
  名称：

  Acidic triazoles as soluble guanylate cyclase stimulators

  摘要：

  A series of acidic triazoles with activity as soluble guanylate cyclase stimulators is described. Incorporation of the CF(3) triazole improved the overall physicochemical and drug-like properties of the molecule and is exemplified by compound 25. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2011.08.071

文献信息

• SUBSTITUTED TRIAZINE DERIVATIVES AND USE THEREOF AS STIMULATORS OF SOLUBLE GUANYLATE CYCLASE
  申请人：Bayer Intellectual Property GmbH

  公开号：US20150094308A1

  公开（公告）日：2015-04-02

  The present application relates to novel substituted fused pyrimidines, to processes for their preparation, to their use alone or in combinations for the treatment and/or prophylaxis of diseases, and to their use for producing medicaments for the treatment and/or prophylaxis of diseases, in particular for the treatment and/or prophylaxis of cardiovascular disorders.

  本申请涉及新颖的取代融合嘧啶化合物，以及它们的制备方法，它们单独或与其他物质结合用于治疗和/或预防疾病，以及它们用于制备治疗和/或预防疾病的药物，特别是用于治疗和/或预防心血管疾病。
• RING-FUSED PYRIMIDINES AND TRIAZINES AND USE THEREOF FOR THE TREATMENT AND/OR PROPHYLAXIS OF CARDIOVASCULAR DISEASES
  申请人：Follmann Markus

  公开号：US20140350020A1

  公开（公告）日：2014-11-27

  The present application relates to novel fused pyrimidines and triazines, to processes for their preparation, to their use alone or in combinations for the treatment and/or prophylaxis of diseases and to their use for preparing medicaments for the treatment and/or prophylaxis of diseases, in particular for the treatment and/or prophylaxis of cardiovascular disorders.

  本申请涉及新型融合嘧啶和三嗪，以及它们的制备方法，它们单独或组合用于治疗和/或预防疾病，以及它们用于制备用于治疗和/或预防疾病的药物，特别是用于治疗和/或预防心血管疾病。
• Substituted triazine derivatives and use thereof as stimulators of soluble guanylate cyclase
  申请人：Bayer Intellectual Property GmbH

  公开号：US09133191B2

  公开（公告）日：2015-09-15

  The present application relates to novel substituted fused pyrimidines, to processes for their preparation, to their use alone or in combinations for the treatment and/or prophylaxis of diseases, and to their use for producing medicaments for the treatment and/or prophylaxis of diseases, in particular for the treatment and/or prophylaxis of cardiovascular disorders.

  本申请涉及新颖的取代融合嘧啶，其制备方法，它们单独或与其他药物组合用于治疗和/或预防疾病，并用于制造治疗和/或预防疾病的药物，特别是用于治疗和/或预防心血管疾病。
• SUBSTITUTED ANNULATED TRIAZINES AND USE THEREOF
  申请人：BAYER INTELLECTUAL PROPERTY GMBH

  公开号：US20150274754A1

  公开（公告）日：2015-10-01

  The present application relates to novel substituted fused pyrimidines and triazines, to processes for their preparation, to their use alone or in combinations for the treatment and/or prophylaxis of diseases, and to their use for producing medicaments for the treatment and/or prophylaxis of diseases, in particular for the treatment and/or prophylaxis of cardiovascular disorders.

  本申请涉及新型取代融合嘧啶和三嗪，其制备方法，它们单独或组合用于治疗和/或预防疾病，以及它们用于制造治疗和/或预防疾病的药物，特别是用于治疗和/或预防心血管疾病。
• Ring-fused pyrimidines and triazines and use thereof for the treatment and/or prophylaxis of cardiovascular diseases
  申请人：Follmann Markus

  公开号：US09216978B2

  公开（公告）日：2015-12-22

  The present application relates to novel fused pyrimidines and triazines, to processes for their preparation, to their use alone or in combinations for the treatment and/or prophylaxis of diseases and to their use for preparing medicaments for the treatment and/or prophylaxis of diseases, in particular for the treatment and/or prophylaxis of cardiovascular disorders.

  本申请涉及新型融合嘧啶和三嗪，以及其制备方法，它们单独或与其他物质联合使用用于治疗和/或预防疾病，以及用于制备治疗和/或预防疾病的药物，特别是用于治疗和/或预防心血管疾病。