N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-4-methoxybenzamide | 1220697-21-1

• 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: N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-4-methoxybenzamide
• CAS: 1220697-21-1
• 化学式: C₁₁H₁₅N₃O₃
• 分子量: 237.258
• InChiKey: ZZZSBSILLSUWFI-ZETCQYMHSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.2
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  93.4
• 氢给体数：
  3
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-4-methoxybenzamide 、 苯甲醛 以 甲醇 为溶剂， 生成 (S,E)-N-(1-(2-benzylidenehydrazinyl)-1-oxopropan-2-yl)-4-methoxybenzamide
  参考文献：
  名称：

  SAR and molecular mechanism study of novel acylhydrazone compounds targeting HIV-1 CA

  摘要：

  We synthesized a series of acylhydrazone compounds bearing naturally occurring amino acids' side chains as HIV assembly inhibitors. Biological evaluation indicated that the compounds had anti-SIV and capsid assembly inhibitory activities. The structure-activity relationship (SAR) study showed that compounds bearing proper aromatic side chains had potential antiviral activities. The molecular modeling experiments revealed the molecular mechanism that they could bind to CA in the same manner as CAP-1 and occupy two more grooves. (C) 2010 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmc.2010.02.003
• 作为产物：
  描述：

  methyl (4-methoxybenzoyl)-L-alaninate 在 一水合肼 作用下， 以 乙醇 为溶剂， 生成 N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-4-methoxybenzamide
  参考文献：
  名称：

  SAR and molecular mechanism study of novel acylhydrazone compounds targeting HIV-1 CA

  摘要：

  We synthesized a series of acylhydrazone compounds bearing naturally occurring amino acids' side chains as HIV assembly inhibitors. Biological evaluation indicated that the compounds had anti-SIV and capsid assembly inhibitory activities. The structure-activity relationship (SAR) study showed that compounds bearing proper aromatic side chains had potential antiviral activities. The molecular modeling experiments revealed the molecular mechanism that they could bind to CA in the same manner as CAP-1 and occupy two more grooves. (C) 2010 Published by Elsevier Ltd.

  DOI：

  10.1016/j.bmc.2010.02.003

文献信息

• Antibacterial agents
  申请人：The University of Washington

  公开号：EP2295402A2

  公开（公告）日：2011-03-16

  Antibacterial compounds of formula (I) are provided: As well as stereoisomers, pharmaceutically acceptable salts, esters, and prodrugs thereof; pharmaceutical compositions comprising such compounds; treating bacterial infections by the administration of such compounds; and processes for the preparation of the compounds.

  提供了式(I)的抗菌化合物：以及其立体异构体、药学上可接受的盐、酯和原药；包含此类化合物的药物组合物；通过服用此类化合物治疗细菌感染；以及制备这些化合物的工艺。