N'-acetyl-4-{3-[4-(3-{4-[(acetylimino)(amino)methyl]phenoxy}propyl)-1-piperidinyl]propoxy}benzamidine

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: N'-acetyl-4-{3-[4-(3-{4-[(acetylimino)(amino)methyl]phenoxy}propyl)-1-piperidinyl]propoxy}benzamidine
• 英文别名: N-[4-[3-[1-[3-[4-(N-acetylcarbamimidoyl)phenoxy]propyl]piperidin-4-yl]propoxy]benzenecarboximidoyl]acetamide
• 化学式: C₂₉H₃₉N₅O₄
• 分子量: 521.66
• InChiKey: PVIVPNJAXMIGCD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.4
• 重原子数：
  38
• 可旋转键数：
  12
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.45
• 拓扑面积：
  133
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  4-{3-[4-(3-{4-[amino(imino)methyl]phenoxy}propyl)-1-piperidinyl]propoxy}benzamidine 、 4-硝基苯基乙酸酯 以 N,N-二甲基甲酰胺 为溶剂， 反应 1.25h， 生成 N'-acetyl-4-{3-[4-(3-{4-[(acetylimino)(amino)methyl]phenoxy}propyl)-1-piperidinyl]propoxy}benzamidine
  参考文献：
  名称：

  ARYLAMIDINE DERIVATIVE, SALT THEREOF AND ANTIFUNGAL CONTAINING THESE

  摘要：

  公开号：

  EP1767526B1

文献信息

• Novel Arylamidine Derivative, Salt Thereof, and Antifungal Containing These
  申请人：Hayashi Kazuya

  公开号：US20080319016A1

  公开（公告）日：2008-12-25

  An arylamidine derivative represented by the general formula (wherein R 1 represents optionally protected or substituted amidino; and R 2 and R 3 are the same or different and each represents hydrogen or halogeno) or a salt of the derivative. The derivative and salt have potent activity against fungi including ones having tolerance to azole type drugs and further have high safety and excellent properties in a repeated dose toxicity test. They are hence useful as an excellent antifungal.

  一种芳基脲衍生物，其通式表示为（其中R1表示可选择性保护或取代的酰胺基; R2和R3相同或不同，每个表示氢或卤素），或其衍生物的盐。该衍生物和盐对真菌具有强效活性，包括对azole类药物具有耐受性的真菌，并且在重复剂量毒性测试中具有高安全性和优异性能。因此，它们可用作优秀的抗真菌剂。
• Arylamidine derivative, salt thereof, and antifungal containing these
  申请人：Toyama Chemical Co., Ltd.

  公开号：US07700623B2

  公开（公告）日：2010-04-20

  An arylamidine derivative represented by the general formula (wherein R1 represents optionally protected or substituted amidino; and R2 and R3 are the same or different and each represents hydrogen or halogeno) or a salt of the derivative. The derivative and salt have potent activity against fungi including ones having tolerance to azole type drugs and further have high safety and excellent properties in a repeated dose toxicity test. They are hence useful as an excellent antifungal.

  一种芳基胺衍生物，由一般式表示（其中R1代表可选择保护或取代的酰胺基；R2和R3相同或不同，每个代表氢或卤素），或其盐。该衍生物和盐对真菌具有强大的活性，包括对氮唑类药物具有耐受性的真菌，并且在重复剂量毒性测试中具有高安全性和优异的性能。因此，它们是一种优秀的抗真菌药物。
• NOVEL ARYLAMIDINE DERIVATIVE, SALT THEREOF, AND ANTIFUNGAL CONTAINING THESE
  申请人：TOYAMA CHEMICAL CO., LTD.

  公开号：EP1767526A1

  公开（公告）日：2007-03-28

  An arylamidine derivative represented by the general formula (wherein R1 represents optionally protected or substituted amidino; and R2 and R3 are the same or different and each represents hydrogen or halogeno) or a salt of the derivative. The derivative and salt have potent activity against fungi including ones having tolerance to azole type drugs and further have high safety and excellent properties in a repeated dose toxicity test. They are hence useful as an excellent antifungal.

  由通式（其中 R1 代表任选保护或取代的脒基，R2 和 R3 相同或不同，各自代表氢或卤素）代表的芳基脒衍生物或该衍生物的盐。这种衍生物和盐对真菌（包括对唑类药物有耐受性的真菌）有很强的活性，而且在重复剂量毒性试验中具有很高的安全性和优异的特性。因此，它们是一种非常有用的抗真菌剂。
• US7700623B2
  申请人：——

  公开号：US7700623B2

  公开（公告）日：2010-04-20