(2-chloro-5-hydroxy-phenyl)acetic acid ethyl ester | 928025-24-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: (2-chloro-5-hydroxy-phenyl)acetic acid ethyl ester
• 英文别名: (2-Chloro-5-hydroxy-phenyl)-acetic acid ethyl ester；ethyl 2-(2-chloro-5-hydroxyphenyl)acetate
• CAS: 928025-24-5
• 化学式: C₁₀H₁₁ClO₃
• 分子量: 214.649
• InChiKey: UBKPCCBIAQEAKZ-UHFFFAOYSA-N

物化性质

• 沸点：
  323.9±27.0 °C(Predicted)
• 密度：
  1.269±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  14
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  46.5
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  (2-chloro-5-hydroxy-phenyl)acetic acid ethyl ester 在 sodium tetrahydroborate 、 三溴化磷 、 potassium carbonate 作用下， 以 1,4-二氧六环 、 甲醇 、 乙二醇二甲醚 为溶剂， 反应 72.17h， 生成 [5-(4-bromo-2-bromomethyl-phenoxy)-2-chloro-phenyl]-acetic acid ethyl ester
  参考文献：
  名称：

  [EN] CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN DCOMPOSÉS DIARYLIQUES CYCLIQUES EN TANT QU'ANTAGONISTES DE RÉCEPTEURS DE PROSTAGLANDINE D220091008US5668176ABAGLEY SCOTT W [US], et al19970916AAWO9503044A1MERCK & CO INC [US], et al19950202AAUS5334598ABAGLEY SCOTT W [US], et al19940802AA
  [FR] COMPOSÉS DIARYLIQUES CYCLIQUES EN TANT QU'ANTAGONISTES DE RÉCEPTEURS DE PROSTAGLANDINE D2

  摘要：

  公开号：

  WO2009102893A3
• 作为产物：
  描述：

  (5-benzyloxy-2-chloro-phenyl)-acetic acid 在 palladium on activated charcoal 硫酸 、 氢气 作用下， 以 乙醇 为溶剂， 生成 (2-chloro-5-hydroxy-phenyl)acetic acid ethyl ester
  参考文献：
  名称：

  [EN] CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN DCOMPOSÉS DIARYLIQUES CYCLIQUES EN TANT QU'ANTAGONISTES DE RÉCEPTEURS DE PROSTAGLANDINE D220091008US5668176ABAGLEY SCOTT W [US], et al19970916AAWO9503044A1MERCK & CO INC [US], et al19950202AAUS5334598ABAGLEY SCOTT W [US], et al19940802AA
  [FR] COMPOSÉS DIARYLIQUES CYCLIQUES EN TANT QU'ANTAGONISTES DE RÉCEPTEURS DE PROSTAGLANDINE D2

  摘要：

  公开号：

  WO2009102893A3

文献信息

• Derivative having ppar agonistic activity
  申请人：Itai Akiko

  公开号：US20090286974A1

  公开（公告）日：2009-11-19

  A compound of the formula (I): a pharmaceutically acceptable salt or solvate thereof, wherein Ring Q is optionally substituted monocyclic aryl, optionally substituted monocyclic heteroaryl, optionally substituted fused aryl or optionally substituted fused heteroaryl, Y 1 is a bond or —NR 6 — or the like, Ring A is optionally substituted nonaromatic heterocyclediyl, a group of the formula: -Y 2 Z 1 - is a group of the formula: R 7 are each independently hydrogen, optionally substituted lower alkyl or the like, R 8 and R 9 are each independently hydrogen or optionally substituted lower alkyl, n is an integer between 1 and 3, Z 1 is a bond, —O—, —S— or —NR 9 —, Ring B is optionally substituted aromatic carbocyclediyl or optionally substituted aromatic heterocyclediyl, Y 3 is a bond, optionally substituted lower alkylene optionally intervened by —O—, optionally substituted lower alkenylene or the like, and Z 2 is COOR 3 or the like.

  化合物的公式（I）：其药物可接受的盐或溶剂，其中环Q是可选择的取代的单环芳基，可选择的取代的单环杂芳基，可选择的融合芳基或可选择的融合杂芳基，Y1是键或-NR6-或类似物，环A是可选择的取代的非芳香杂环二基，公式组：-Y2Z1-是公式组：R7各自独立地是氢，可选择的取代的低烷基或类似物，R8和R9各自独立地是氢或可选择的取代的低烷基，n是1到3之间的整数，Z1是键，-O-，-S-或-NR9-，环B是可选择的取代的芳香碳杂环二基或可选择的取代的芳香杂环二基，Y3是键，可选择的取代的低烷基，可选择地介入-O-，可选择的取代的低烯基或类似物，并且Z2是COOR3或类似物。
• N,N-disubstituted aminoalkylbiphenyl antagonists of prostaglandin D2 receptors
  申请人：Panmira Pharmaceuticals, LLC

  公开号：US08067445B2

  公开（公告）日：2011-11-29

  Described herein are compounds that are antagonists of PGD2 receptors. Also described are pharmaceutical compositions and medicaments that include the compounds described herein that are antagonists of PGD2 receptors. Also described herein are methods of using such antagonists of PGD2 receptors, alone and in combination with other compounds, for treating respiratory, cardiovascular, and other PGD2-dependent or PGD2-mediated conditions or diseases.

  本文描述了一些PGD2受体拮抗剂化合物。还描述了包含这些PGD2受体拮抗剂化合物的药物组合物和药物。本文还描述了使用这些PGD2受体拮抗剂，单独或与其他化合物结合，治疗呼吸系统、心血管系统和其他依赖或介导于PGD2的疾病或病症的方法。
• N,N-DISUBSTITUTED AMINOALKYLBIPHENYL ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS
  申请人：HUTCHINSON John Howard

  公开号：US20120058123A1

  公开（公告）日：2012-03-08

  Described herein are compounds that are antagonists of PGD 2 receptors. Also described are pharmaceutical compositions and medicaments that include the compounds described herein that are antagonists of PGD 2 receptors. Also described herein are methods of using such antagonists of PGD 2 receptors, alone and in combination with other compounds, for treating respiratory, cardiovascular, and other PGD 2 -dependent or PGD 2 -mediated conditions or diseases.

  本文描述了一些PGD2受体拮抗剂化合物。还描述了包括这些PGD2受体拮抗剂化合物的药物组合物和药物。此外，还描述了使用这些PGD2受体拮抗剂，单独或与其他化合物联合治疗呼吸系统、心血管系统和其他PGD2依赖性或PGD2介导的疾病或病症的方法。
• CYCLIC DIARYL ETHER COMPOUNDS AS ANTAGONISTS OF PROSTAGLANDIN D2 RECEPTORS
  申请人：Hutchinson John Howard

  公开号：US20110098302A1

  公开（公告）日：2011-04-28

  Described herein are compounds that are antagonists of PGD 2 receptors. Also described are pharmaceutical compositions and medicaments that include the antagonists of PGD 2 receptors described herein, as well as methods of using such antagonists of PGD 2 receptors, alone and in combination with other compounds, for treating respiratory, cardiovascular, and other PGD 2 -dependent or PGD 2 -mediated conditions or diseases.

  本文描述了PGD2受体拮抗剂化合物。还描述了包括本文所述的PGD2受体拮抗剂在内的制药组合物和药物，以及使用这种PGD2受体拮抗剂，单独或与其他化合物结合，治疗呼吸系统、心血管系统和其他PGD2依赖性或PGD2介导的疾病或病症的方法。
• Cyclic diaryl ether compounds as antagonists of prostaglandin D2 receptors
  申请人：Panmira Pharmaceuticals, LLC

  公开号：US08242145B2

  公开（公告）日：2012-08-14

  Described herein are compounds that are antagonists of PGD2 receptors. Also described are pharmaceutical compositions and medicaments that include the antagonists of PGD2 receptors described herein, as well as methods of using such antagonists of PGD2 receptors, alone and in combination with other compounds, for treating respiratory, cardiovascular, and other PGD2-dependent or PGD2-mediated conditions or diseases.

  本文介绍了PGD2受体拮抗剂化合物。还介绍了包括这些PGD2受体拮抗剂在内的制药组合物和药物，以及使用这些PGD2受体拮抗剂的方法，单独或与其他化合物结合，用于治疗呼吸系统、心血管系统和其他依赖或介导PGD2的疾病或病症。