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5-chloro-N-cyclohexyl-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide | 302560-96-9

中文名称
——
中文别名
——
英文名称
5-chloro-N-cyclohexyl-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide
英文别名
5-Chloro-N~4~-cyclohexyl-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide;5-chloro-N-cyclohexyl-3-methyl-1-phenylpyrazole-4-carboxamide
5-chloro-N-cyclohexyl-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide化学式
CAS
302560-96-9
化学式
C17H20ClN3O
mdl
MFCD00405091
分子量
317.818
InChiKey
BFJYNBFFHQILFL-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

物化性质

  • 沸点:
    467.9±45.0 °C(Predicted)
  • 密度:
    1.28±0.1 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    4.3
  • 重原子数:
    22
  • 可旋转键数:
    3
  • 环数:
    3.0
  • sp3杂化的碳原子比例:
    0.41
  • 拓扑面积:
    46.9
  • 氢给体数:
    1
  • 氢受体数:
    2

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:
    描述:
    5-chloro-N-cyclohexyl-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide甲醇 为溶剂, 生成 N-cyclohexyl-3-methyl-1-phenyl-1H-pyrazole-4-carboxamide
    参考文献:
    名称:
    N-芳基邻氯杂芳烃甲酰胺的光环化合成吡唑并[4,3-c]喹啉-4-酮和吲哚[3,2-c]喹啉-6-酮
    摘要:
    5-氯-N-苯基-1 H-吡唑光环化高效合成吡唑并[4,3-C]喹啉-4-酮和吲哚[3,2-C]喹啉-6-酮丙酮中的 -4-羧酰胺和 2-氯-N-苯基-1 H-吲哚-3-羧酰胺。
    DOI:
    10.1055/s-2008-1067013
  • 作为产物:
    参考文献:
    名称:
    Synthesis and Evaluation of the Fungal Activity of New Pyrazole-Carboxamides Against Colletotrichum gloeosporioides
    摘要:
    The pyrazole core has been recognized by their biological properties and included in the synthesis of modern agrochemicals. Part of these studies consists of making structural modifications to pesticides for commercial purposes to increase efficacy. In this article, we present the synthesis of four new pyrazol-4-carboxamide 8a-8d derivatives (PCD), through a four-step synthetic protocol, starting with edaravone 1 and primary amines like benzo-fused. aliphatic, and hydrazines. through a process of low environmental impact. Synthesized derivatives were evaluated against one fungal strain of Colletotrichum gloeosporioides BA3, fungus that causes several losses to farmers around the world, through in vitro sensitivity tests. The compound 8c showed better inhibiting behavior against Colletotrichum gloeosporioides BA3, inducing a lag phase of almost 2.77 days. These results were obtained via Gompertz modeling. for the first time reported for biological evaluation of pyrazole-carboxamide derivatives against Colletotrichum gloeosporioides.
    DOI:
    10.21577/0103-5053.20200092
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