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3-chloro-4-(2,4-dichlorophenylthio)aniline

中文名称
——
中文别名
——
英文名称
3-chloro-4-(2,4-dichlorophenylthio)aniline
英文别名
3-Chloro-4-[(2,4-dichlorophenyl)thio]benzenamine;3-chloro-4-(2,4-dichlorophenyl)sulfanylaniline
3-chloro-4-(2,4-dichlorophenylthio)aniline化学式
CAS
——
化学式
C12H8Cl3NS
mdl
——
分子量
304.627
InChiKey
BLXNJVXRNFFUPU-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):
    5.2
  • 重原子数:
    17
  • 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:
    51.3
  • 氢给体数:
    1
  • 氢受体数:
    2

上下游信息

  • 下游产品
    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:
    DE2313721
    摘要:
    公开号:
  • 作为产物:
    描述:
    2,4-二氯苯硫酚3-氯苯胺二叔丁基过氧化物 作用下, 反应 24.0h, 以92%的产率得到3-chloro-4-(2,4-dichlorophenylthio)aniline
    参考文献:
    名称:
    Metal-Free Iodine-Catalyzed Direct Arylthiation of Substituted Anilines with Thiols
    摘要:
    Iodine-catalyzed direct arylthiation of substituted anilines for the synthesis of various diaryl sulfides has been developed under metal- and solvent-free conditions. The present method uses readily available thiols as the arylthiation reagents, and environmentally friendly and inexpensive I-2 as the catalyst. Importantly, no base or ligand was necessary. Such a simple, efficient, and economical transformation provides an attractive approach to various diaryl sulfides in good to excellent yields.
    DOI:
    10.1021/acs.joc.5b00540
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文献信息

  • INHIBITORS OF LFA-1 BINDING TO ICAMs AND USES THEREOF
    申请人:ICOS CORPORATION
    公开号:EP1165504A2
    公开(公告)日:2002-01-02
  • [EN] INHIBITORS OF LFA-1 BINDING TO ICAMs AND USES THEREOF<br/>[FR] INHIBITEURS DE LA LIAISON DE LFA-1 A DES ICAMS ICAMS ET LIEURS UTILISATIONS
    申请人:ICOS CORP
    公开号:WO2000059878A2
    公开(公告)日:2000-10-12
    The present invention is directed to compounds that bind to a novel regulatory site in the I domain of LFA-1, and thereby inhibit LFA-1 binding to ICAMs that bind LFA-1. The present invention therefore also provides methods to regulate leukocyte adhesion to endothelial cells. Compounds of the ivnention are useful for the treatment of pathologies, such as those associated inflammatory diseases, autoimmune diseases, tumor metastasis, allograft rejection and reperfusion injury. In particular, the present invention is directed to diaryl sulfides of general structural formula (I), a pharmaceutically acceptable salt, or prodrug thereof, and to the use of diaryl sulfides, and particularly compounds of formula (I), to inhibit LFA-1 binding to an ICAM that binds LFA-1 wherein A and B, independently, are aryl groups selected from the group consisting of 5- and 6-membered aromatic rings, including, but not limited to, phenyl, thienyl, furyl, pyrimidinyl, imidazolyl, pyrazolyl, pyridyl, pyrazinyl, pyrrolyl, and pyridazinyl.
  • Metal-Free Iodine-Catalyzed Direct Arylthiation of Substituted Anilines with Thiols
    作者:Daoshan Yang、Kelu Yan、Wei Wei、Jing Zhao、Mengqi Zhang、Xuguang Sheng、Guoqing Li、Shenglei Lu、Hua Wang
    DOI:10.1021/acs.joc.5b00540
    日期:2015.6.19
    Iodine-catalyzed direct arylthiation of substituted anilines for the synthesis of various diaryl sulfides has been developed under metal- and solvent-free conditions. The present method uses readily available thiols as the arylthiation reagents, and environmentally friendly and inexpensive I-2 as the catalyst. Importantly, no base or ligand was necessary. Such a simple, efficient, and economical transformation provides an attractive approach to various diaryl sulfides in good to excellent yields.
  • DE2313721
    申请人:——
    公开号:——
    公开(公告)日:——
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