Ethyl 6-methyl-4-oxochromane-3-carboxylate | 1161762-43-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并吡喃
• 英文名称: Ethyl 6-methyl-4-oxochromane-3-carboxylate
• 英文别名: ethyl 6-methyl-4-oxo-2,3-dihydrochromene-3-carboxylate
• CAS: 1161762-43-1
• 化学式: C₁₃H₁₄O₄
• 分子量: 234.252
• InChiKey: KBPQYTAYWVIGIG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  17
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.38
• 拓扑面积：
  52.6
• 氢给体数：
  0
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  Ethyl 6-methyl-4-oxochromane-3-carboxylate 在 三乙基硅烷 、 三氟乙酸 作用下， 反应 14.0h， 生成 Ethyl 6-methylchromane-3-carboxylate
  参考文献：
  名称：

  Chroman-3-amides as potent Rho kinase inhibitors

  摘要：

  Inhibition of Rho kinase (ROCK) is an attractive strategy for the treatment of diseases such as hypertension, glaucoma, and cancer. Here we report chroman-3-amides as highly potent ROCK inhibitors with sufficient kinase selectivity, excellent cell activity, good microsomal stability, and desirable pharmacokinetic properties for study as potential therapeutic agents. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.10.080
• 作为产物：
  描述：

  6-甲基-4-苯并二氢呋喃-4-酮 、 氯甲酸乙酯 在 lithium hexamethyldisilazane 作用下， 以 四氢呋喃 为溶剂， 反应 1.5h， 生成 Ethyl 6-methyl-4-oxochromane-3-carboxylate
  参考文献：
  名称：

  Chroman-3-amides as potent Rho kinase inhibitors

  摘要：

  Inhibition of Rho kinase (ROCK) is an attractive strategy for the treatment of diseases such as hypertension, glaucoma, and cancer. Here we report chroman-3-amides as highly potent ROCK inhibitors with sufficient kinase selectivity, excellent cell activity, good microsomal stability, and desirable pharmacokinetic properties for study as potential therapeutic agents. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2008.10.080

文献信息

• BENZOPYRANS AND ANALOGS AS RHO KINASE INHIBITORS
  申请人：Feng Yangbo

  公开号：US20110150833A1

  公开（公告）日：2011-06-23

  Compounds useful as Rho kinase inhibitors of formula (1) wherein the variables are as defined herein are provided. Methods of treatment of malconditions mediated by Rho kinase, and methods of preparation of the compounds, are also provided.

  提供了一些公式（1）中变量的Rho激酶抑制剂，这些化合物可用于治疗由Rho激酶介导的疾病。还提供了制备这些化合物的方法和治疗Rho激酶介导的疾病的方法。
• [EN] BENZOPYRANS AND ANALOGS AS RHO KINASE INHIBITORS<br/>[FR] BENZOPYRANES ET ANALOGUES UTILISÉS COMME INHIBITEURS DE LA RHO KINASE
  申请人：FENG YANGBO

  公开号：WO2009079008A1

  公开（公告）日：2009-06-25

  Compounds useful as Rho kinase inhibitors of formula (I) wherein the variables are as defined herein are provided. Methods of treatment of malconditions mediated by Rho kinase, and methods of preparation of the compounds, are also provided.
• Chroman-3-amides as potent Rho kinase inhibitors
  作者：Yen Ting Chen、Thomas D. Bannister、Amiee Weiser、Evelyn Griffin、Li Lin、Claudia Ruiz、Michael D. Cameron、Stephan Schürer、Derek Duckett、Thomas Schröter、Philip LoGrasso、Yangbo Feng

  DOI：10.1016/j.bmcl.2008.10.080

  日期：2008.12

  Inhibition of Rho kinase (ROCK) is an attractive strategy for the treatment of diseases such as hypertension, glaucoma, and cancer. Here we report chroman-3-amides as highly potent ROCK inhibitors with sufficient kinase selectivity, excellent cell activity, good microsomal stability, and desirable pharmacokinetic properties for study as potential therapeutic agents. (C) 2008 Elsevier Ltd. All rights reserved.