2-bromo-N-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]propanamide | 199339-05-4

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 2-bromo-N-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]propanamide
• CAS: 199339-05-4
• 化学式: C₁₁H₉BrClN₃O₂
• 分子量: 330.568
• InChiKey: RHMUJIGXVJIQHW-UHFFFAOYSA-N

物化性质

• 密度：
  1.660±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  68
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  potassium 1-pyrrolidinecarbodithioate 、 2-bromo-N-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]propanamide 以 乙醇 为溶剂， 反应 1.0h， 以50%的产率得到[1-[[5-(4-Chlorophenyl)-1,3,4-oxadiazol-2-yl]amino]-1-oxopropan-2-yl] pyrrolidine-1-carbodithioate
  参考文献：
  名称：

  Synthesis and antimicrobial activity of some 5-aryl-2-[(N,N-disubstituted thiocarbamoylthio)acylamino]-1,3,4-oxadiazoles

  摘要：

  In this study, a number of novel 5-aryl-2-[(N,N-disubstituted thiocarbamoylthio)acylamino]-1,3,4-oxadiazole derivatives were synthesized by the reaction of potassium salts of N,N-disubstituted dithiocarbamoic acids with 2-[(alpha-chloro-alpha-phenylacetyl/alpha-bromopropionyl)-amino]-5-aryl-1,3,4-oxadiazoles. Structures of the compounds were confirmed by the spectral data (IR, H-1 NMR, EIMS) and elemental analyses. Most of the compounds were tested against various microorganisms and four of them were found to be weakly active against Staphylococcus aureus and Staphylococcus epidermidis. (C) 1998 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(98)00063-9
• 作为产物：
  描述：

  4-chlorobenzaldehyde semicarbazone 在 吡啶 、 溴 、 sodium acetate 作用下， 以 溶剂黄146 为溶剂， 生成 2-bromo-N-[5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]propanamide
  参考文献：
  名称：

  Synthesis and antimicrobial activity of some 5-aryl-2-[(N,N-disubstituted thiocarbamoylthio)acylamino]-1,3,4-oxadiazoles

  摘要：

  In this study, a number of novel 5-aryl-2-[(N,N-disubstituted thiocarbamoylthio)acylamino]-1,3,4-oxadiazole derivatives were synthesized by the reaction of potassium salts of N,N-disubstituted dithiocarbamoic acids with 2-[(alpha-chloro-alpha-phenylacetyl/alpha-bromopropionyl)-amino]-5-aryl-1,3,4-oxadiazoles. Structures of the compounds were confirmed by the spectral data (IR, H-1 NMR, EIMS) and elemental analyses. Most of the compounds were tested against various microorganisms and four of them were found to be weakly active against Staphylococcus aureus and Staphylococcus epidermidis. (C) 1998 Elsevier Science S.A. All rights reserved.

  DOI：

  10.1016/s0014-827x(98)00063-9

文献信息

• Ates, Oeznur; Kocabalkanlr, Ayse; Sanis, Guelten Oetuek, Arzneimittel-Forschung/Drug Research, 1997, vol. 47, # 10, p. 1134 - 1138
  作者：Ates, Oeznur、Kocabalkanlr, Ayse、Sanis, Guelten Oetuek、Ekinci, Ahmet C.、Vidin, Aylin

  DOI：——

  日期：——