1,3,5-trimethyl-1H-pyrazol-4-yl benzoate | 1138677-39-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1,3,5-trimethyl-1H-pyrazol-4-yl benzoate
• 英文别名: (1,3,5-trimethylpyrazol-4-yl) benzoate
• CAS: 1138677-39-0
• 化学式: C₁₃H₁₄N₂O₂
• 分子量: 230.266
• InChiKey: VODYQZOOGOVSAL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  44.1
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  1,3,5-trimethyl-1H-pyrazol-4-yl benzoate 在 sodium hydroxide 、 乙醇 、 水 作用下， 反应 2.0h， 以78%的产率得到1,3,5-三甲基吡唑-4-醇
  参考文献：
  名称：

  [EN] PYRIDIN-2 -YL-AMINO-I, 2, 4 -THIADIAZOLE DERIVATIVES AS GLUCOKINASE ACTIVATORS FOR THE TREATMENT OF DIABETES MELLITUS
  [FR] ACTIVATEURS DE GLUCOKINASE

  摘要：

  公开号：

  WO2009042435A8
• 作为产物：
  描述：

  3-(苯甲酰氧基)-2,4-戊烷二酮 、 甲基肼 以 乙醇 为溶剂， 反应 2.0h， 以to afford 1,3,5-trimethyl-1H-pyrazol-4-yl benzoate (80 g, 92.6% yield)的产率得到1,3,5-trimethyl-1H-pyrazol-4-yl benzoate
  参考文献：
  名称：

  Intermediates for the preparation of pyridin-2-yl-amino-1,2,4-thiadiazole derivatives

  摘要：

  提供的中间体具有以下公式，其中R2，R3和L如说明书所定义，这些中间体在制备吡啶-2-基氨基-1,2,4-噻二唑衍生物时是有用的。

  公开号：

  US09079890B2

文献信息

• Pyridin-2-YL-Amino-1, 2, 4-Thiadiazole Derivatives as Glucokinase Activators for the Treatment of Diabetes Mellitus
  申请人：Aicher Thomas Daniel

  公开号：US20100204240A1

  公开（公告）日：2010-08-12

  Provided are compounds of Formula (I): wherein R 2 , R 3 , R 13 , L and D 2 are as defined in the specification, which are useful in the treatment and/or prevention of diseases or disorders mediated by deficient levels of glucokinase activity or which can be treated by activating glucokinase including, but not limited to, diabetes mellitus, impaired glucose tolerance, IFG (impaired fasting glucose) and IFG (impaired fasting glycemia), as well as other diseases and disorders such as those discussed herein.

  提供的化合物式(I)如下：其中R2、R3、R13、L和D2如规范中所定义，这些化合物可用于治疗和/或预防由于葡萄糖激酶活性不足引起或可以通过激活葡萄糖激酶治疗的疾病或紊乱，包括但不限于糖尿病、糖耐量受损、IFG（空腹血糖受损）和IFG（空腹高血糖），以及本文所讨论的其他疾病和紊乱。
• Pyridin-2YL-Amino-1, 2, 4-Thiadiazole Derivatives as Glucokinase Activators for the Treatment of Diabetes Mellitus
  申请人：AICHER Thomas Daniel

  公开号：US20120277242A1

  公开（公告）日：2012-11-01

  Provided are compounds of Formula (I): wherein R 2 , R 3 , R 13 , L and D 2 are as defined in the specification, which are useful in the treatment and/or prevention of diseases or disorders mediated by deficient levels of glucokinase activity or which can be treated by activating glucokinase including, but not limited to, diabetes mellitus, impaired glucose tolerance, IFG (impaired fasting glucose) and IFG (impaired fasting glycemia), as well as other diseases and disorders such as those discussed herein.

  本发明提供了式(I)的化合物：其中R2、R3、R13、L和D2如规范中所定义，它们在治疗和/或预防由葡萄糖激酶活性不足介导的疾病或疾病中有用，或者可以通过激活葡萄糖激酶来治疗，包括但不限于糖尿病、糖耐量受损、IFG（空腹血糖受损）和IFG（空腹高血糖），以及其他疾病和疾病，如在此处所讨论的。
• Pyridin-2-yl-amino-1, 2, 4-thiadiazole derivatives as glucokinase activators for the treatment of diabetes mellitus
  申请人：Array BioPharma, Inc.

  公开号：US08212045B2

  公开（公告）日：2012-07-03

  Provided are compounds of Formula (I): wherein R2, R3, R13, L and D2 are as defined in the specification, which are useful in the treatment and/or prevention of diseases or disorders mediated by deficient levels of glucokinase activity or which can be treated by activating glucokinase including, but not limited to, diabetes mellitus, impaired glucose tolerance, IFG (impaired fasting glucose) and IFG (impaired fasting glycemia), as well as other diseases and disorders such as those discussed herein.

  提供的化合物式(I)如下：其中R2、R3、R13、L和D2如规范中所定义，可用于治疗和/或预防由于葡萄糖激酶活性不足而介导的疾病或疾病，或可通过激活葡萄糖激酶来治疗，包括但不限于糖尿病、糖耐量受损、空腹血糖受损(IFG)和空腹高血糖(IFG)，以及其他在此处讨论的疾病和紊乱。
• Pyridin-2yl-amino-1, 2, 4-thiadiazole derivatives as glucokinase activators for the treatment of diabetes mellitus
  申请人：Aicher Thomas Daniel

  公开号：US08853409B2

  公开（公告）日：2014-10-07

  Provided are compounds of Formula (I): wherein R2, R3, R13, L and D2 are as defined in the specification, which are useful in the treatment and/or prevention of diseases or disorders mediated by deficient levels of glucokinase activity or which can be treated by activating glucokinase including, but not limited to, diabetes mellitus, impaired glucose tolerance, IFG (impaired fasting glucose) and IFG (impaired fasting glycemia), as well as other diseases and disorders such as those discussed herein.

  提供的是公式（I）化合物：其中R2，R3，R13，L和D2如规范中所定义，这些化合物对于治疗和/或预防由葡萄糖激酶活性不足引起或可以通过激活葡萄糖激酶来治疗的疾病或疾病具有用处，包括但不限于糖尿病，糖耐量受损，IFG（空腹血糖受损）和IFG（空腹高血糖），以及其他疾病和疾病，如本文所述。
• INTERMEDIATES FOR THE PREPARATION OF PYRIDIN-2-YL-AMINO-1,2,4-THIADIAZOLE DERIVATIVES
  申请人：Array BioPharma Inc.

  公开号：US20150057448A1

  公开（公告）日：2015-02-26

  Provided are intermediates having the formulas wherein R 2 , R 3 , and L are as defined in the specification, which are useful in the preparation of pyridin-2-yl-amino-1,2,4-thiadiazole derivatives.

  提供了中间体的公式，其中R2，R3和L的定义如规范中所述，这些中间体在制备吡啶-2-基氨基-1,2,4-噻二唑衍生物中很有用。