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4-benzyl-3-[[1-(4-methylphenyl)-4-thiophen-2-ylimidazol-2-yl]sulfanylmethyl]-1H-1,2,4-triazole-5-thione

中文名称
——
中文别名
——
英文名称
4-benzyl-3-[[1-(4-methylphenyl)-4-thiophen-2-ylimidazol-2-yl]sulfanylmethyl]-1H-1,2,4-triazole-5-thione
英文别名
——
4-benzyl-3-[[1-(4-methylphenyl)-4-thiophen-2-ylimidazol-2-yl]sulfanylmethyl]-1H-1,2,4-triazole-5-thione化学式
CAS
——
化学式
C24H21N5S3
mdl
——
分子量
475.7
InChiKey
HXVGAKJNMITMCO-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):
    5.5
  • 重原子数:
    32
  • 可旋转键数:
    7
  • 环数:
    5.0
  • sp3杂化的碳原子比例:
    0.12
  • 拓扑面积:
    131
  • 氢给体数:
    1
  • 氢受体数:
    5

文献信息

  • Treatment and/or prevention of bone metastasis
    申请人:The Arizona Board of Regents on behalf of The University of Arizona
    公开号:US10179142B2
    公开(公告)日:2019-01-15
    T-lymphocyte invasion and metastases (Tiam-1) has been identified as a marker and anti-cancer drug target for therapy of metastatic bone cancer in individuals afflicted with prostate cancer. The present disclosure provides methods and compounds for inhibiting metastases by disrupting Tiam-1 expression and activity. One particularly preferred compound comprises a disulfomanide of the formula.
    T淋巴细胞侵袭和转移(Tiam-1)已被确定为治疗前列腺癌患者转移性骨癌的标志物和抗癌药物靶点。本公开提供了通过破坏 Tiam-1 的表达和活性来抑制转移的方法和化合物。其中一种特别优选的化合物包括式中的二硫化氢
  • TREATMENT AND OR PREVENTION OF METASTATIC PROSTATE CANCER
    申请人:The Arizona Board Of Regents On Behalf Of The University Of Arizona
    公开号:EP3041469B1
    公开(公告)日:2021-06-30
  • TREATMENT AND/OR PREVENTION OF BONE METASTASIS
    申请人:The Arizona Board of Regents on behalf of The University of Arizona
    公开号:US20160213693A1
    公开(公告)日:2016-07-28
    T-lymphocyte invasion and metastases (Tiam-1) has been identified as a marker and anti-cancer drug target for therapy of metastatic bone cancer in individuals afflicted with prostate cancer. The present disclosure provides methods and compounds for inhibiting metastases by disrupting Tiam-1 expression and activity. One particularly preferred compound comprises a disulfomanide of the formula.
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