(4S)-2,2-二甲基-1,3-二氧戊环-4-羧酸钾盐 | 117205-81-9

• 物质功能分类: 有机原料 - 羧酸类化合物及衍生物
• 分子结构分类: 有机化合物 - 有机氧化合物
• 中文名称: (4S)-2,2-二甲基-1,3-二氧戊环-4-羧酸钾盐
• CAS: 117205-81-9
• 化学式: C6H10KO4
• 分子量: 185.24
• InChiKey: UDCDXDJERYPICD-WCCKRBBISA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.16
• 重原子数：
  11
• 可旋转键数：
  1
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.83
• 拓扑面积：
  55.8
• 氢给体数：
  1
• 氢受体数：
  4

安全信息

• 海关编码：
  2932999099
• 危险性防范说明：
  P261,P264,P270,P271,P280,P301+P312,P302+P352,P304+P340,P305+P351+P338,P330,P332+P313,P337+P313,P362,P403+P233,P405,P501
• 危险性描述：
  H302,H315,H319,H335

反应信息

• 作为反应物：
  描述：

  (4S)-2,2-二甲基-1,3-二氧戊环-4-羧酸钾盐 以46的产率得到(3S)-3,4-dihydroxybutanoneacetonide
  参考文献：
  名称：

  NOVEL COMPOUND 395

  摘要：

  化合物式（1）及其药学上可接受的盐，用于治疗趋化因子介导的疾病和病况。

  公开号：

  US20100016275A1

文献信息

• [EN] HETEROCYCLIC AMIDE DERIVATIVES WHICH POSSESS GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY<br/>[FR] DERIVES AMIDES HETEROCYCLIQUES POSSEDANT UNE ACTIVITE INHIBITRICE DE GLYCOGENE PHOSPHORYLASE
  申请人：ASTRAZENECA AB

  公开号：WO2005018637A1

  公开（公告）日：2005-03-03

  A compound of the formula (1) or a pharmaceutically-acceptable salt, or pro-drug thereof; (1) wherein, for example: R4 and R5 together are either -S-C(R6=C(R7)- or -C(R7)=C(R6)-S- ; R6 and R7 are independently selected from hydrogen and halo; A is phenylene or heteroarylene; n is 0, 1 or 2; R1 is halo, cyano or carboxy; R2 is for example methyl; R3 is for example selected from halo(1-4C)alkyl, dihalo(1-4C)alkyl, trifluoromethyl, hydroxy(1-4C)alkyl, dihydroxy(2-4C)alkyl, trihydroxy(3-4C)alkyl, cyano(1-4C)alkyl (optionally substituted on alkyl with hydroxy), (1-4C)alkoxy(1-4C)alkyl, (1-4C)alkoxy(1-4C)alkoxy(1-4C)alkyl, di[(1-4C)alkoxy](1-4C)alkyl, (hydroxy)[(1-4C)alkoxy](1-4C)alkyl; possess glycogen phosphorylase inhibitory activity and accordingly have value in the treatment of disease states associated with increased glycogen phosphorylase activity. Processes for the manufacture of compounds and pharmaceutical compositions containing them are described.

  该化合物的分子式为（1）或其药用可接受的盐或前药；（1）其中，例如：R4和R5一起是-S-C(R6=C(R7)-或-C(R7)=C(R6)-S-；R6和R7分别选择自氢和卤素；A是苯基或杂环芳基；n为0、1或2；R1为卤素、氰基或羧基；R2为例如甲基；R3为例如选择自卤(1-4C)烷基、二卤(1-4C)烷基、三氟甲基、羟基(1-4C)烷基、二羟基(2-4C)烷基、三羟基(3-4C)烷基、氰基(1-4C)烷基（在烷基上可选择性地取代羟基）、（1-4C)烷氧基(1-4C)烷基、（1-4C)烷氧基(1-4C)烷氧基(1-4C)烷基、二[(1-4C)烷氧](1-4C)烷基、(羟基)[(1-4C)烷氧](1-4C)烷基；具有糖原磷酸化酶抑制活性，因此在治疗与糖原磷酸化酶活性增加相关的疾病状态中具有价值。描述了制备化合物和含有它们的药物组合物的方法。
• [EN] INDOL-2-AMIDES AS GLYCOGEN PHOSPHORYLASE INHIBITORS<br/>[FR] INDOL-2-AMIDES COMME INHIBITEURS DE LA GLYCOGENE PHOSPHORYLASE
  申请人：ASTRAZENECA AB

  公开号：WO2005019172A1

  公开（公告）日：2005-03-03

  A compound of the formula (1) or a pharmaceutically-acceptable salt, or pro-drug thereof; (1) wherein, for example, R 4 is halo or (1-4C)alkyl ; A is phenylene or heteroarylene; n is 0, 1 or 2; m is 0, 1 or 2; R 1 is halo, cyano or carboxy; R 2 is for example methyl; R 3 is for example selected from halo(1-4C)alkyl, dihalo(1-4C)alkyl, trifluoromethyl, hydroxy(1-4C)alkyl, dihydroxy(2-4C)alkyl, trihydroxy(3-4C)alkyl, cyano(1-4C)alkyl (optionally substituted on alkyl with hydroxy), (1-4C)alkoxy(1-4C)alkyl, (1-4C)alkoxy(1-4C)alkoxy(1-4C)alkyl, di[(1-4C)alkoxy](1-4C)alkyl, (hydroxy)[(1-4C)alkoxy](1-4C)alkyl; possess glycogen phosphorylase inhibitory activity and accordingly have value in the treatment of disease states associated with increased glycogen phosphorylase activity. Processes for the manufacture of compounds and pharmaceutical compositions containing them are described.

  一种具有以下式（1）的化合物，或其药用可接受的盐或前药；（1）其中，例如，R4是卤素或（1-4C）烷基；A是苯基或杂环芳基；n为0、1或2；m为0、1或2；R1为卤素、氰基或羧基；R2为例如甲基；R3为例如选择自卤代（1-4C）烷基、二卤代（1-4C）烷基、三氟甲基、羟基（1-4C）烷基、二羟基（2-4C）烷基、三羟基（3-4C）烷基、氰基（1-4C）烷基（在烷基上可选择性地取代羟基）、（1-4C）烷氧基（1-4C）烷基、（1-4C）烷氧基（1-4C）烷氧基（1-4C）烷基、二[(1-4C）烷氧基]（1-4C）烷基、（羟基）[(1-4C）烷氧基]（1-4C）烷基；具有糖原磷酸化酶抑制活性，因此在治疗与糖原磷酸化酶活性增加相关的疾病状态中具有价值。描述了制备化合物和含有它们的药物组合物的方法。
• NOVEL COMPOUND 395
  申请人：MEGHANI PREMJI

  公开号：US20100016275A1

  公开（公告）日：2010-01-21

  A compound of formula (1) and pharmaceutically acceptable salts thereof for use in the treatment of chemokine mediated diseases and conditions.

  化合物式（1）及其药学上可接受的盐，用于治疗趋化因子介导的疾病和病况。
• Indol-2-amides as glycogen phosphorylase inhibitors
  申请人：Bennett Lile Stuart Norman

  公开号：US20060199966A1

  公开（公告）日：2006-09-07

  A compound of the formula (1) or a pharmaceutically-acceptable salt, or pro-drug thereof; (1) wherein, for example, R 4 is halo or (1-4C)alkyl; A is phenylene or heteroarylene; n is 0, 1 or 2; m is 0, 1 or 2; R 1 is halo, cyano or carboxy; R 2 is for example methyl; R 3 is for example selected from halo(1-4C)alkyl, dihalo(1-4C)alkyl, trifluoromethyl, hydroxy(1-4C)alkyl, dihydroxy(2-4C)alkyl, trihydroxy(3-4C)alkyl, cyano(1-4C)alkyl (optionally substituted on alkyl with hydroxy), (1-4C)alkoxy(1-4C)alkyl, (1-4C)alkoxy(1-4C)alkoxy(1-4C)alkyl, di[(1-4C)alkoxy](1-4C)alkyl, (hydroxy)[(1-4C)alkoxy](1-4C)alkyl; possess glycogen phosphorylase inhibitory activity and accordingly have value in the treatment of disease states associated with increased glycogen phosphorylase activity. Processes for the manufacture of compounds and pharmaceutical compositions containing them are described.

  公式（1）的化合物或其药学上可接受的盐或前药；（1）其中，例如，R4是卤素或（1-4C）烷基；A是苯基或杂环芳基；n为0、1或2；m为0、1或2；R1为卤素、氰基或羧基；R2例如为甲基；R3例如从卤（1-4C）烷基、二卤（1-4C）烷基、三氟甲基、羟基（1-4C）烷基、二羟基（2-4C）烷基、三羟基（3-4C）烷基、氰基（1-4C）烷基（在烷基上可选地用羟基取代）、（1-4C）烷氧基（1-4C）烷基、（1-4C）烷氧基（1-4C）烷氧基（1-4C）烷基、二[(1-4C）烷氧基]（1-4C）烷基、（羟基）[(1-4C）烷氧基]（1-4C）烷基；具有糖原磷酸化酶抑制活性，因此在治疗与糖原磷酸化酶活性增加相关的疾病状态方面具有价值。描述了制造化合物和含有它们的制药组合物的过程。
• Heterocyclic amide derivatives which process glycogen phorylase inhibitory activity
  申请人：Bennett Norman Lile Stuart

  公开号：US20060264494A1

  公开（公告）日：2006-11-23

  A compound of the formula (1) or a pharmaceutically-acceptable salt, or pro-drug thereof; (1) wherein, for example: R 4 and R 5 together are either —S—C(R 6 ═C(R 7 )— or —C(R 7 )═C(R 6 )—S—; R 6 and R 7 are independently selected from hydrogen and halo; A is phenylene or heteroarylene; n is 0, 1 or 2; R 1 is halo, cyano or carboxy; R 2 is for example methyl; R 3 is for example selected from halo(1-4C)alkyl, dihalo(1-4C)alkyl, tifluoromethyl, hydroxy(1-4C)alkyl, dihydroxy(2-4C)alkyl, trihydroxy(3-4C)alkyl, cyano(1-4C)alkyl (optionally substituted on alkyl with hydroxy), (1-4C)alkoxy(1-4C)alkyl, (1-4C)alkoxy(1-4C)alkoxy(1-4C)alkyl, di[(1-4C)alkoxy](1-4C)alkyl, (hydroxy)[(1-4C)alkoxy](1-4C)alkyl; possess glycogen phosphorylase inhibitory activity and accordingly have value in the treatment of disease states associated with increased glycogen phosphorylase activity. Processes for the manufacture of compounds and pharmaceutical compositions containing them are described.

  公式（1）的化合物或其药物可接受的盐或前药；（1）其中，例如：R4和R5一起是- S-C（R6═C（R7） -或-C（R7）═C（R6） -S-; R6和R7分别选择氢和卤素; A是苯基或杂环芳基; n为0、1或2; R1为卤素、氰基或羧基; R2为例如甲基; R3例如选择自卤（1-4C）烷基、二卤（1-4C）烷基、三氟甲基、羟基（1-4C）烷基、二羟基（2-4C）烷基、三羟基（3-4C）烷基、氰基（1-4C）烷基（在烷基上可选择性地用羟基取代）、（1-4C）烷氧基（1-4C）烷基、（1-4C）烷氧基（1-4C）烷氧基（1-4C）烷基、二（（1-4C）烷氧基）（1-4C）烷基、（羟基）（（1-4C）烷氧基）（1-4C）烷基; 具有糖原磷酸化酶抑制活性，因此在治疗与糖原磷酸化酶活性增加相关的疾病状态方面具有价值。描述了制备化合物和含有它们的制药组合物的过程。