methyl 5-(1,2-dihydroxypropyl)-2-pyridinecarboxylate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: methyl 5-(1,2-dihydroxypropyl)-2-pyridinecarboxylate
• 英文别名: methyl 5-(1,2-dihydroxypropyl)pyridine-2-carboxylate
• 化学式: C₁₀H₁₃NO₄
• 分子量: 211.218
• InChiKey: XZXCYBBAXJQLFQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.1
• 重原子数：
  15
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  79.6
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  methyl 5-(1,2-dihydroxypropyl)-2-pyridinecarboxylate 在 氮气 作用下， 以 吡啶 、 乙酸酐 为溶剂， 反应 1.0h， 以to give methyl 5-(1,2-diacetoxypropyl)-2-pyridinecarboxylate的产率得到methyl 5-(1,2-diacetoxypropyl)-2-pyridinecarboxylate
  参考文献：
  名称：

  5-substituted picolinic acid compounds and their method of use

  摘要：

  本发明提供了式（I）的新型5-取代吡啶甲酸化合物或其药学上可接受的盐：其中R1和R2独立地为H，C2-C6酰基或卤代苯甲酰基；R3为—C（O）O—C1-C6烷基，C（O）OH，CN，CONH2，CONHCH3，CON（CH3）2，1-甲基四唑或2-甲基四唑，但当R2为乙酰基且R3为甲氧羰基时，R1不为H；当R3为CN，CONH2，CONHCH3，CON（CH3）2，1-甲基四唑或2-甲基四唑时，R1和R2为H。本发明还涉及一种包括本发明化合物的药物组合物，用于治疗IL-1和TNF介导的疾病或类似疾病。本发明还涉及一种制备式（I）化合物的方法。

  公开号：

  US06194442B1

文献信息

• 5-Substituted picolinic acid compounds and their production process
  申请人：Pfizer Inc.

  公开号：US06034107A1

  公开（公告）日：2000-03-07

  The present invention provides novel 5-substituted picolinic acid compounds of formula (I) or a pharmaceutically acceptable salt thereof: ##STR1## wherein R.sup.1 and R.sup.2 are independently H, C.sub.2 -C.sub.6 acyl or halo-substituted benzoyl; and R.sup.3 is --C(O)O--C.sub.1 -C.sub.6 alkyl, C(O)OH, CN, CONH.sub.2, CONHCH.sub.3, CON(CH.sub.3).sub.2, 1-methyltetrazole or 2-methyltetrazole, with the proviso that when R.sub.2 is acetyl and R.sup.3 is methoxycarbonyl, R.sup.1 is not H; and that when R.sup.3 is CN, CONH.sub.2, CONHCH.sub.3, CON(CH.sub.3).sub.2, 1-methyltetrazole or 2-methyltetrazole, R.sup.1 and R.sup.2 are H. The present invention also relates to a pharmaceutical composition comprising compound of the present invention, which is useful in the treatment of IL-1 and TNF mediated diseases or the like. The present invention further relates to a process for producing the compounds of the formula (I).

  本发明提供了式（I）的新型5-取代吡啶甲酸化合物或其药学上可接受的盐： 其中R^1和R^2分别为H，C.sub.2-C.sub.6酰基或卤代苯甲酰基；R^3为--C(O)O--C.sub.1-C.sub.6烷基，C(O)OH，CN，CONH.sub.2，CONHCH.sub.3，CON(CH.sub.3).sub.2，1-甲基四唑或2-甲基四唑，但当R^2为乙酰基且R^3为甲氧羰基时，R^1不是H；当R^3为CN，CONH.sub.2，CONHCH.sub.3，CON(CH.sub.3).sub.2，1-甲基四唑或2-甲基四唑时，R^1和R^2为H。本发明还涉及包含本发明化合物的药物组合物，用于治疗IL-1和TNF介导的疾病或类似疾病。本发明还涉及一种生产式（I）化合物的方法。
• 5-substituted picolinic acid compounds production by Marasmiellus sp
  申请人：Pfizer Inc.

  公开号：US06416979B1

  公开（公告）日：2002-07-09

  The present invention provides novel 5-substituted picolinic acid compounds of formula (I) or a pharmaceutically acceptable salt thereof: wherein R1 and R2 are independently H, C2-C6 acyl or halo-substituted benzoyl; and R3 is —C(O)O—C1-C6 alkyl, C(O)OH, CN, CONH2, CONHCH3, CON(CH3)2, 1-methyltetrazole or 2-methyltetrazole, with the proviso that when R2 is acetyl and R3 is methoxycarbonyl, R1 is not H; and that when R3 is CN, CONH2, CONHCH3, CON(CH3)2, 1-methyltetrazole or 2-methyltetrazole, R1 and R2 are H. The present invention also relates to a pharmaceutical composition comprising compound of the present invention, which is useful in the treatment of IL-1 and TNF mediated diseases or the like. The present invention further relates to a process for producing the compounds of the formula (I).

  本发明提供了式（I）的新型5-取代吡啶甲酸化合物或其药学上可接受的盐：其中R1和R2分别是H、C2-C6酰基或卤代苯甲酰基；R3是—C（O）O—C1-C6烷基、C（O）OH、CN、CONH2、CONHCH3、CON（CH3）2、1-甲基四唑或2-甲基四唑，但当R2为乙酰基且R3为甲氧基羰基时，R1不为H；当R3为CN、CONH2、CONHCH3、CON（CH3）2、1-甲基四唑或2-甲基四唑时，R1和R2为H。本发明还涉及一种包括本发明化合物的药物组合物，其在治疗IL-1和TNF介导的疾病等方面有用。本发明还涉及一种制备式（I）化合物的方法。
• Picolin acid derivatives useful in the treatment of IL-1 and TNF mediated diseases
  申请人：PFIZER INC.

  公开号：EP0926137B1

  公开（公告）日：2004-05-12
• JPH11222480A
  申请人：——

  公开号：JPH11222480A

  公开（公告）日：1999-08-17
• US6034107A
  申请人：——

  公开号：US6034107A

  公开（公告）日：2000-03-07