2-acetylaminophenyl-(3-nitro-2-pyridyl)sulfide | 91902-18-0

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 2-acetylaminophenyl-(3-nitro-2-pyridyl)sulfide
• 英文别名: N-(2-((3-nitropyridin-2-yl)thio)phenyl)acetamide；2'-(3-Nitro-2-pyridylthio)-acetanilid；acetic acid-[2-(3-nitro-[2]pyridylmercapto)-anilide]；Essigsaeure-[2-(3-nitro-[2]pyridylmercapto)-anilid]；N-{2-[(3-Nitropyridin-2-yl)sulfanyl]phenyl}acetamide；N-[2-(3-nitropyridin-2-yl)sulfanylphenyl]acetamide
• CAS: 91902-18-0
• 化学式: C₁₃H₁₁N₃O₃S
• 分子量: 289.315
• InChiKey: OXUOGFGPGGANJG-UHFFFAOYSA-N

物化性质

• 熔点：
  138-139 °C(Solv: isopropanol (67-63-0))
• 沸点：
  480.0±40.0 °C(Predicted)
• 密度：
  1.40±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  113
• 氢给体数：
  1
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  2-acetylaminophenyl-(3-nitro-2-pyridyl)sulfide 在 盐酸 、 氢氧化钾 、 sodium amide 、 xylene 作用下， 生成 氮异丙嗪
  参考文献：
  名称：

  10-(Dialkylaminoalkyl)-pyrido[3,2-b][1,4]benzothiazine (1-Azaphenothiazine) and Related Compounds

  摘要：

  DOI：

  10.1021/ja01540a035
• 作为产物：
  描述：

  2-氨基苯硫醇 在 甲醇 、 氢氧化钾 、 乙醇 作用下， 生成 2-acetylaminophenyl-(3-nitro-2-pyridyl)sulfide
  参考文献：
  名称：

  10-(Dialkylaminoalkyl)-pyrido[3,2-b][1,4]benzothiazine (1-Azaphenothiazine) and Related Compounds

  摘要：

  DOI：

  10.1021/ja01540a035

文献信息

• 화합물, 이를 포함하는 유기발광소자, 이를 포함하는 유기발광소자용 조성물 및 상기 유기발광소자를 포함하는 표시장치
  申请人：CHEIL INDUSTRIES INC. 제일모직주식회사(119980034532) Corp. No ▼ 170111-0000076BRN ▼504-81-00025

  公开号：KR20150012906A

  公开（公告）日：2015-02-04

  화합물, 이를 포함하는 유기발광소자, 이를 포함하는 유기발광소자용 조성물 및 상기 유기발광소자를 포함하는 표시장치에 관한 것으로, 하기 화학식 1로 표시되는 유기광전자소자용 화합물을 제공한다. [화학식 1]

  这是关于含有化合物的有机发光器件、含有该化合物的有机发光器件用配方以及含有该有机发光器件的显示装置的专利说明，提供了用于有机光电器件的化合物，其化学式如下所示：[化学式 1]
• Synthesis and antimicrobial activity of novel bis-azaphenothiazines
  作者：Khushbu Kushwaha、Rajeev Sakhuja、Subhash C. Jain

  DOI：10.1007/s00044-012-0454-7

  日期：2013.9

  N-alkylation of azaphenothiazines using dibromoalkanes or dibromoalkenes did not result in the formation of bis-azaphenothiazines under known conditions such as refluxing, for more than 100 h, with NaNH2/xylene or NaH/toluene. However, when the same reaction was tried with NaH/DMF at -5 A degrees C to r.t., it yielded the desired product in 68-71 % yield. These novel bis-azaphenothiazines containing a suitable alkyl or alkenyl spacer were found to possess moderate to significant antimicrobial activities against three gram positive bacteria (Staphylococcus aureus, Bacillus subtilis, and Staphylococcus epidermis), four gram negative bacteria (Escherichia coli, Pseudomonas aeruginosa, Salmonella typhi, and Klebsiella pneumoniae) as well as four fungi (Aspergillus niger, Aspergillus fumigatus, Aspergillus flavus, and Candida albicans). Compounds 2b-d were found to exhibit strong antifungal activity, comparable to the standard drug miconazole against A. niger and A. fumigatus.