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N-[(2-chlorophenyl)methylideneamino]-4-hydroxybenzamide

中文名称
——
中文别名
——
英文名称
N-[(2-chlorophenyl)methylideneamino]-4-hydroxybenzamide
英文别名
——
N-[(2-chlorophenyl)methylideneamino]-4-hydroxybenzamide化学式
CAS
——
化学式
C14H11ClN2O2
mdl
——
分子量
274.707
InChiKey
RTFXGOLWDKMXKC-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    2.8
  • 重原子数:
    19
  • 可旋转键数:
    3
  • 环数:
    2.0
  • sp3杂化的碳原子比例:
    0.0
  • 拓扑面积:
    61.7
  • 氢给体数:
    2
  • 氢受体数:
    3

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    参考文献:
    名称:
    Oxadiazole based Os(IV) compounds as potential DNA intercalator and cytotoxic agents
    摘要:
    Os(IV) compounds and ligands have been synthesized and well characterized. DNA cleavage tendency of compounds has been evaluated using gel electrophoresis and binding behavior has been evaluated by viscosity measurements, absorption titration, fluorescence, and docking studies. All the compounds show the intercalation mode of binding. The binding constant of complexes falls at about 1.8-7.6 x 10(4) M-1 Bacteriostatic activity of compounds has been evaluated on a series of gram(+ve )and gram(-ve) bacteria in terms of their MIC values. Also, the compounds have been screened for in vivo and in vitro cytotoxicity assays on S. Pombe cell's DNA and HCT-116 cell line. LC50 of ligands and Os(IV) complexes are in the range of 7.92-19.91 and 4.00-11.74 mu g/mL respectively.
    DOI:
    10.1016/j.inoche.2020.108070
  • 作为产物:
    描述:
    参考文献:
    名称:
    对结核分枝杆菌 H37Rv 具有抗结核活性的新型苯甲酰肼衍生物的合成、药代动力学和分子对接研究
    摘要:
    结核病祸害是最值得注意的危险,迫切需要确定新的防御措施。一系列新的苯甲酰肼衍生物,含有亚苄基苯甲酰肼与 2-溴-1-(4-氟苯基)乙酮通过亚甲氧基连接。苯甲酰肼衍生物的表征通过1 H 和13 C NMR、FT-IR 和质谱法进行。对合成的化合物进行抗微生物活性筛选,并在计算机筛选中进行评估。所有合成的化合物对体外抗结核分枝杆菌H37Rv 和 4 小时的抗结核活性测量显示超过 99% 的生长抑制。
    DOI:
    10.1016/j.molstruc.2021.131884
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文献信息

  • Oxadiazole based Os(IV) compounds as potential DNA intercalator and cytotoxic agents
    作者:Bharat H. Pursuwani、Bhupesh S. Bhatt、Foram U. Vaidya、Chandramani Pathak、Mohan N. Patel
    DOI:10.1016/j.inoche.2020.108070
    日期:2020.9
    Os(IV) compounds and ligands have been synthesized and well characterized. DNA cleavage tendency of compounds has been evaluated using gel electrophoresis and binding behavior has been evaluated by viscosity measurements, absorption titration, fluorescence, and docking studies. All the compounds show the intercalation mode of binding. The binding constant of complexes falls at about 1.8-7.6 x 10(4) M-1 Bacteriostatic activity of compounds has been evaluated on a series of gram(+ve )and gram(-ve) bacteria in terms of their MIC values. Also, the compounds have been screened for in vivo and in vitro cytotoxicity assays on S. Pombe cell's DNA and HCT-116 cell line. LC50 of ligands and Os(IV) complexes are in the range of 7.92-19.91 and 4.00-11.74 mu g/mL respectively.
  • Synthesis, pharmacokinetic and molecular docking studies of new benzohydrazide derivatives possessing anti-tubercular activity against Mycobacterium tuberculosis H37Rv
    作者:Nilam H. Lalavani、Himani R. Gandhi、Krishna A. Bhensdadia、Rajesh K. Patel、Shipra H. Baluja
    DOI:10.1016/j.molstruc.2021.131884
    日期:2022.2
    defenses against it. A new series of benzohydrazide derivatives containing benzylidene benzohydrazide linkage with 2-bromo-1-(4-fluorophenyl)ethanone via methylene-oxy group. The characterization of benzohydrazide derivatives was performed by 1H and 13C NMR, FT-IR and mass spectrometry. The synthesized compounds were screened for antimicrobial activity and evaluated for in silico screening. All the synthesized
    结核病祸害是最值得注意的危险,迫切需要确定新的防御措施。一系列新的苯甲酰肼衍生物,含有亚苄基苯甲酰肼与 2-溴-1-(4-氟苯基)乙酮通过亚甲氧基连接。苯甲酰肼衍生物的表征通过1 H 和13 C NMR、FT-IR 和质谱法进行。对合成的化合物进行抗微生物活性筛选,并在计算机筛选中进行评估。所有合成的化合物对体外抗结核分枝杆菌H37Rv 和 4 小时的抗结核活性测量显示超过 99% 的生长抑制。
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