methyl N-[6-[4-[(2-chlorobenzoyl)amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate | 209803-84-9

• 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: methyl N-[6-[4-[(2-chlorobenzoyl)amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate
• CAS: 209803-84-9
• 化学式: C₂₂H₁₇ClN₄O₃S
• 分子量: 452.921
• InChiKey: HJCXCIPHUXMRFB-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  31
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  121
• 氢给体数：
  3
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  对氯苯异氰酸酯 、 methyl N-[6-[4-[(2-chlorobenzoyl)amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate 以 二甲基亚砜 为溶剂， 反应 3.0h， 生成
  参考文献：
  名称：

  Reaction of Methyl 5(6)-(4-Aminophenylthio)-2-benzimidazolylcarbamate with Carboxylic Acid Chlorides

  摘要：

  Methyl 5(6)-(4-aminophenylthio)-2-benzimidazolylcarbamate was reacted with carboxylic acid chlorides to obtain mono- and disubstitution products. The formation of the former involves the aniline nitrogen and of the latter, both the aniline and benzimidazole nitrogens. Biological properties of the products are studied.

  DOI：

  10.1023/b:rugc.0000015999.23658.b5
• 作为产物：
  描述：

  邻氯苯甲酰氯 、 N-[6-[(4-氨基苯基)硫代]-1H-苯并咪唑-2-基]-氨基甲酸甲酯 在 吡啶 作用下， 以97.7%的产率得到methyl N-[6-[4-[(2-chlorobenzoyl)amino]phenyl]sulfanyl-1H-benzimidazol-2-yl]carbamate
  参考文献：
  名称：

  Reaction of Methyl 5(6)-(4-Aminophenylthio)-2-benzimidazolylcarbamate with Carboxylic Acid Chlorides

  摘要：

  Methyl 5(6)-(4-aminophenylthio)-2-benzimidazolylcarbamate was reacted with carboxylic acid chlorides to obtain mono- and disubstitution products. The formation of the former involves the aniline nitrogen and of the latter, both the aniline and benzimidazole nitrogens. Biological properties of the products are studied.

  DOI：

  10.1023/b:rugc.0000015999.23658.b5

文献信息

• Reaction of Methyl 5(6)-(4-Aminophenylthio)-2-benzimidazolylcarbamate with Carboxylic Acid Chlorides
  作者：V. S. Pilyugin、A. N. Mikhailyuk、V. M. Kosareva、G. E. Chikisheva、E. V. Klimakova、T. P. Vorob'eva

  DOI：10.1023/b:rugc.0000015999.23658.b5

  日期：2003.9

  Methyl 5(6)-(4-aminophenylthio)-2-benzimidazolylcarbamate was reacted with carboxylic acid chlorides to obtain mono- and disubstitution products. The formation of the former involves the aniline nitrogen and of the latter, both the aniline and benzimidazole nitrogens. Biological properties of the products are studied.