dihydrosventrin hydrochloride | 1042449-10-4

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: dihydrosventrin hydrochloride
• 英文别名: 4,5-dibromo-1-methyl-pyrrole-2-carboxylic acid [3-(2-amino-1H-imidazol-4-yl)-propyl]-amide hydrochloride；N-[3-(2-amino-1H-imidazol-5-yl)propyl]-4,5-dibromo-1-methylpyrrole-2-carboxamide;hydrochloride
• CAS: 1042449-10-4
• 化学式: C₁₂H₁₅Br₂N₅O*ClH
• 分子量: 441.553
• InChiKey: JCOMZOPHHVPMTP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.64
• 重原子数：
  21
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  88.7
• 氢给体数：
  4
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-Amino-5-(3-amino-propylidene)-1,5-dihydro-imidazol-4-one dihydrochloride 、 dihydrosventrin hydrochloride 、 以gave 0.048 g (47%) of the title compound 32 as a tan solid ((Z)-isomer exclusively)的产率得到4,5-Dibromo-1-methyl-pyrrole-2-carboxylic acid [3-(2-amino-5-oxo-3,5-dihydro-imidazol-4-ylidene)-propyl]-amide hydrochloride
  参考文献：
  名称：

  Inhibition of bacterial biofilms with imidazole derivatives

  摘要：

  本文提供了一种咪唑衍生物化合物的披露，该化合物可以预防、去除和/或抑制生物膜的形成，还包括含有这些化合物的组合物、含有这些化合物的设备以及使用它们的方法。

  公开号：

  US09084423B2
• 作为产物：
  描述：

  Tert-butyl 2-amino-4-[3-[(4,5-dibromo-1-methylpyrrole-2-carbonyl)amino]propyl]imidazole-1-carboxylate 在 三氟乙酸 、 盐酸 作用下， 以 二氯甲烷 、 乙醚 为溶剂， 反应 12.0h， 以97%的产率得到dihydrosventrin hydrochloride
  参考文献：
  名称：

  Antibiofilm Activity of a Diverse Oroidin Library Generated through Reductive Acylation

  摘要：

  A diverse 20-compound library of analogues based on the marine alkaloid oroidin were synthesized via a reductive acylation strategy. The final target was then assayed for inhibition and dispersion activity against common proteo-bacteria known to form biofilms. This methodology represents a significant improvement over the generality of known methods to acylate substrates containing 2-aminoimidazoles and has the potential to have broad application to the synthesis of more advanced oroidin family members and their corresponding analogues.

  DOI：

  10.1021/jo802260t

文献信息

• INHIBITION OF BACTERIAL BIOFILMS WITH IMIDAZOLE DERIVATIVES
  申请人：Melander Christian

  公开号：US20080181923A1

  公开（公告）日：2008-07-31

  Disclosure is provided for imidazole derivative compounds that prevent, remove and/or inhibit the formation of biofilms, compositions comprising these compounds, devices comprising these compounds, and methods of using the same.

  公开披露了一种咪唑衍生物化合物，可预防、去除和/或抑制生物膜的形成，包括这些化合物的组合物、包括这些化合物的设备，以及使用它们的方法。
• Inhibition of bacterial biofilms with imidazole derivatives
  申请人：North Carolina State University

  公开号：US07906544B2

  公开（公告）日：2011-03-15

  Disclosure is provided for imidazole derivative compounds that prevent, remove and/or inhibit the formation of biofilms, compositions comprising these compounds, devices comprising these compounds, and methods of using the same.

  本文提供了一种咪唑衍生物化合物的披露，该化合物可以预防、去除和/或抑制生物膜的形成，以及包含这些化合物的组合物、包含这些化合物的装置和使用这些化合物的方法。
• INHIBITION OF BIOFILMS IN PLANTS WITH IMIDAZOLE DERIVATIVES
  申请人：Melander Christian

  公开号：US20120328577A1

  公开（公告）日：2012-12-27

  Disclosure is provided for methods of preventing, removing or inhibiting microbial biofilm formation or microbial infection in a plant or plant part thereof, including applying thereto a treatment effective amount of an active compound as described herein, or an agriculturally acceptable salt thereof. Methods of enhancing a microbicide (e.g., including a copper, antibiotic, bacteriophage, etc.) and/or plant defense activator are also provided, including applying an active compound as described herein. Compositions comprising an active compound as described herein in an agriculturally acceptable carrier are also provided, and in some embodiments the compositions further include a microbicide (e.g., including copper, antibiotic, bacteriophage, etc.) and/or plant defense activator.

  公开了在植物或其部分上预防、去除或抑制微生物生物膜形成或微生物感染的方法，包括施加有效量的本文所述的活性化合物或其农业可接受的盐。还提供了增强微生物杀菌剂（例如，包括铜、抗生素、噬菌体等）和/或植物防御激活剂的方法，包括应用本文所述的活性化合物。还提供了包含本文所述的活性化合物在农业可接受载体中的组合物，在某些实施例中，该组合物还包括微生物杀菌剂（例如，包括铜、抗生素、噬菌体等）和/或植物防御激活剂。
• US7906544B2
  申请人：——

  公开号：US7906544B2

  公开（公告）日：2011-03-15
• Antibiofilm Activity of a Diverse Oroidin Library Generated through Reductive Acylation
  作者：T. Eric Ballard、Justin J. Richards、Arianexys Aquino、Catherine S. Reed、Christian Melander

  DOI：10.1021/jo802260t

  日期：2009.2.20

  A diverse 20-compound library of analogues based on the marine alkaloid oroidin were synthesized via a reductive acylation strategy. The final target was then assayed for inhibition and dispersion activity against common proteo-bacteria known to form biofilms. This methodology represents a significant improvement over the generality of known methods to acylate substrates containing 2-aminoimidazoles and has the potential to have broad application to the synthesis of more advanced oroidin family members and their corresponding analogues.