Tert-butyl 2-amino-4-[3-(naphthalen-2-ylsulfonylamino)propyl]imidazole-1-carboxylate | 1176233-57-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: Tert-butyl 2-amino-4-[3-(naphthalen-2-ylsulfonylamino)propyl]imidazole-1-carboxylate
• CAS: 1176233-57-0
• 化学式: C₂₁H₂₆N₄O₄S
• 分子量: 430.528
• InChiKey: IKIBHMNVHSSFSA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  30
• 可旋转键数：
  8
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  125
• 氢给体数：
  2
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  Tert-butyl 2-amino-4-[3-(naphthalen-2-ylsulfonylamino)propyl]imidazole-1-carboxylate 、 三氟乙酸 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  Amide Isosteres of Oroidin: Assessment of Antibiofilm Activity and C. elegans Toxicity

  摘要：

  The synthesis and antibiofilm activities of sulfonamide, urea, and thiourea oroidin analogues arc described. The most active derivative was able to selectively inhibit P. aeruginosa biofilm development and is also shown to be nontoxic upward of 1 mM to the development of C. elegans in comparison to other similar isosteric analogues and the natural product oroidin.

  DOI：

  10.1021/jm900378s
• 作为产物：
  描述：

  tert-butyl 2-amino-4-(3-aminopropyl)-1H-imidazole-1-carboxylate 、 2-萘磺酰氯 在 三乙胺 作用下， 以 四氢呋喃 、 二氯甲烷 为溶剂， 以0.122 g的产率得到Tert-butyl 2-amino-4-[3-(naphthalen-2-ylsulfonylamino)propyl]imidazole-1-carboxylate
  参考文献：
  名称：

  Amide Isosteres of Oroidin: Assessment of Antibiofilm Activity and C. elegans Toxicity

  摘要：

  The synthesis and antibiofilm activities of sulfonamide, urea, and thiourea oroidin analogues arc described. The most active derivative was able to selectively inhibit P. aeruginosa biofilm development and is also shown to be nontoxic upward of 1 mM to the development of C. elegans in comparison to other similar isosteric analogues and the natural product oroidin.

  DOI：

  10.1021/jm900378s

文献信息

• Amide Isosteres of Oroidin: Assessment of Antibiofilm Activity and <i>C. elegans</i> Toxicity
  作者：Justin J. Richards、Samuel Reyes、Sean D. Stowe、Ashley T. Tucker、T. Eric Ballard、Laura D. Mathies、John Cavanagh、Christian Melander

  DOI：10.1021/jm900378s

  日期：2009.8.13

  The synthesis and antibiofilm activities of sulfonamide, urea, and thiourea oroidin analogues arc described. The most active derivative was able to selectively inhibit P. aeruginosa biofilm development and is also shown to be nontoxic upward of 1 mM to the development of C. elegans in comparison to other similar isosteric analogues and the natural product oroidin.