3-[3-(4-Chloro-phenyl)-ureido]-5-phenyl-thiophene-2-carboxylic acid

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 3-[3-(4-Chloro-phenyl)-ureido]-5-phenyl-thiophene-2-carboxylic acid
• 英文别名: 3-[(4-chlorophenyl)carbamoylamino]-5-phenylthiophene-2-carboxylic acid
• 化学式: C₁₈H₁₃ClN₂O₃S
• 分子量: 372.8
• InChiKey: JYPSLSKJZFPZLL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  107
• 氢给体数：
  3
• 氢受体数：
  4

文献信息

• METHODS OF IDENTIFYING COMPOUNDS THAT INHIBIT THE ACTIVATION OF A BIOMOLECULE AND METHODS OF TREATMENT USING THE COMPOUNDS
  申请人：Malliavin Thérèse

  公开号：US20110065782A1

  公开（公告）日：2011-03-17

  The present invention relates to methods of identifying compounds that inhibit the activation between a biomolecule, pharmaceutical compositions comprising such compounds, and methods of treating and/or to reducing the risk of Bacillus anthracis and Bordetella pertussis infection by administering such pharmaceutical compositions.