2-hydroxy-3,5-dinitro-N-(5-nitrothiazol-2-yl)benzamide | 1415566-89-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 酚类
• 英文名称: 2-hydroxy-3,5-dinitro-N-(5-nitrothiazol-2-yl)benzamide
• 英文别名: 2-hydroxy-3,5-dinitro-N-(5-nitro-1,3-thiazol-2-yl)benzamide
• CAS: 1415566-89-0
• 化学式: C₁₀H₅N₅O₈S
• 分子量: 355.244
• InChiKey: YZQFROKGFSLMPU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.1
• 重原子数：
  24
• 可旋转键数：
  2
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  228
• 氢给体数：
  2
• 氢受体数：
  10

反应信息

• 作为产物：
  描述：

  2-氨基-5-硝基噻唑 、 2-hydroxy-3,5-dinitro-benzoyl chloride 在 N,N-二异丙基乙胺 作用下， 以 二氯甲烷 为溶剂， 以66%的产率得到2-hydroxy-3,5-dinitro-N-(5-nitrothiazol-2-yl)benzamide
  参考文献：
  名称：

  Development of 5-nitrothiazole derivatives: Identification of leads against both replicative and latent Mycobacterium tuberculosis

  摘要：

  Twenty eight 5-nitrothiazole derivatives were synthesized and evaluated for in vitro activities against Mycobacterium tuberculosis (MTB), cytotoxicity against HEK 293T. Among the compounds, 5-nitro-N-(5-nitrothiazol-2-yl)furan-2-carboxamide (20) was found to be the most active compound in vitro with MICs of 5.48 mu M against log-phase culture of MTB and also non-toxic up to 100 mu M. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.bmcl.2012.10.060

文献信息

• Development of 5-nitrothiazole derivatives: Identification of leads against both replicative and latent Mycobacterium tuberculosis
  作者：Variam Ullas Jeankumar、Manoj Chandran、Ganesh Samala、Mallika Alvala、Pulla Venkat Koushik、Perumal Yogeeswari、Elena G. Salina、Dharmarajan Sriram

  DOI：10.1016/j.bmcl.2012.10.060

  日期：2012.12

  Twenty eight 5-nitrothiazole derivatives were synthesized and evaluated for in vitro activities against Mycobacterium tuberculosis (MTB), cytotoxicity against HEK 293T. Among the compounds, 5-nitro-N-(5-nitrothiazol-2-yl)furan-2-carboxamide (20) was found to be the most active compound in vitro with MICs of 5.48 mu M against log-phase culture of MTB and also non-toxic up to 100 mu M. (C) 2012 Elsevier Ltd. All rights reserved.