Methyl 2-amino-5-hydroxy-6,7-dimethyl-4-(p-tolylsulfanyl)benzofuran-3-carboxylate | 1257240-02-0

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: Methyl 2-amino-5-hydroxy-6,7-dimethyl-4-(p-tolylsulfanyl)benzofuran-3-carboxylate
• 英文别名: methyl 2-amino-5-hydroxy-6,7-dimethyl-4-(4-methylphenyl)sulfanyl-1-benzofuran-3-carboxylate
• CAS: 1257240-02-0
• 化学式: C₁₉H₁₉NO₄S
• 分子量: 357.43
• InChiKey: RVHWQMPLKAXOCX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.2
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  111
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  Methyl 2-(2-chloro-4,5-dimethyl-3,6-dioxo-cyclohexa-1,4-dien-1-yl)-2-cyano-acetate 、 4-甲苯硫酚 以 乙醇 为溶剂， 反应 5.0h， 生成 Methyl 2-amino-5-hydroxy-6,7-dimethyl-4-(p-tolylsulfanyl)benzofuran-3-carboxylate
  参考文献：
  名称：

  Synthesis and antifungal activity of benzofuran-5-ols

  摘要：

  Benzofuran-5-ol derivatives were synthesized and tested for in vitro antifungal activity against Candida, Aspergillus species, and Cryptococcus neoformans. Among them tested, many benzofuran-5-ols showed good antifungal activity. The results suggest that benzofuran-5-ols would be promising antifungal agents. (C) 2010 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2010.08.129

文献信息

• Synthesis and antifungal activity of benzofuran-5-ols
  作者：Chung-Kyu Ryu、Ae Li Song、Jung Yoon Lee、Jung An Hong、Joo Hee Yoon、Aram Kim

  DOI：10.1016/j.bmcl.2010.08.129

  日期：2010.11

  Benzofuran-5-ol derivatives were synthesized and tested for in vitro antifungal activity against Candida, Aspergillus species, and Cryptococcus neoformans. Among them tested, many benzofuran-5-ols showed good antifungal activity. The results suggest that benzofuran-5-ols would be promising antifungal agents. (C) 2010 Elsevier Ltd. All rights reserved.