1-(1-(2-oxo-2H-chromen-3-yl)ethylidene)-2-(4-(4-iodophenyl)thiazol-2-yl)hydrazine | 1383115-13-6

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 香豆素及其衍生物
• 英文名称: 1-(1-(2-oxo-2H-chromen-3-yl)ethylidene)-2-(4-(4-iodophenyl)thiazol-2-yl)hydrazine
• 英文别名: 3-[N-[[4-(4-iodophenyl)-1,3-thiazol-2-yl]amino]-C-methylcarbonimidoyl]chromen-2-one
• CAS: 1383115-13-6
• 化学式: C₂₀H₁₄IN₃O₂S
• 分子量: 487.321
• InChiKey: MZMZWRXSUJVMOA-UHFFFAOYSA-N

物化性质

• 熔点：
  153-155 °C
• 沸点：
  628.8±65.0 °C(predicted)
• 密度：
  1.68±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.36
• 重原子数：
  27.0
• 可旋转键数：
  4.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  67.49
• 氢给体数：
  1.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  3-乙酰基香豆素 在 溶剂黄146 作用下， 以 乙醇 为溶剂， 反应 34.0h， 生成 1-(1-(2-oxo-2H-chromen-3-yl)ethylidene)-2-(4-(4-iodophenyl)thiazol-2-yl)hydrazine
  参考文献：
  名称：

  Synthesis, anti-Candida activity, and cytotoxicity of new (4-(4-iodophenyl)thiazol-2-yl)hydrazine derivatives

  摘要：

  Novel (4-(4-iodophenyl)-thiazol-2-yl)hydrazine derivatives were assayed for their in vitro anti-Candida activity, compared to topical and systemic antifungal drugs, against twenty-seven clinical isolates. The presence of aliphatic chains or specific heteroaromatic rings on hydrazone moiety at position C2 and a 4-iodophenyl at C4 of the thiazole ring gave a promising inhibitory activity especially against Candida albicans and Candida krusei. The most active compounds have been also evaluated for their cytotoxicity and in association with clotrimazole for anti-Candida activity. (C) 2012 Elsevier Masson SAS. All rights reserved.

  DOI：

  10.1016/j.ejmech.2012.04.006