4-(2,3-dimethylphenyl)-5-methyl-4H-1,2,4-triazol-3-yl hydrosulfide | 384847-90-9

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 4-(2,3-dimethylphenyl)-5-methyl-4H-1,2,4-triazol-3-yl hydrosulfide
• 英文别名: 4-(2,3-dimethylphenyl)-3-methyl-1H-1,2,4-triazole-5-thione
• CAS: 384847-90-9
• 化学式: C₁₁H₁₃N₃S
• 分子量: 219.31
• InChiKey: GTAKZNPTPMSKQI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  15
• 可旋转键数：
  1
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  59.7
• 氢给体数：
  1
• 氢受体数：
  2

文献信息

• Chemical Fragment Screening and Assembly Utilizing Common Chemistry for NMR Probe Introduction and Fragment Linkage
  申请人：Sem Daniel S.

  公开号：US20100305326A1

  公开（公告）日：2010-12-02

  Disclosed herein are methods related to drug development. The methods typically include steps whereby two chemical fragments are identified as binding to a target protein and subsequently the two chemical fragments are joined to create a new chemical entity that binds to the target protein.
• Surface Modified Metal Nano-Particle and Use Thereof
  申请人：LEE Sang Joon

  公开号：US20120168681A1

  公开（公告）日：2012-07-05

  The present invention provides a metal nanoparticle that is surface-modified with a hydrophilic or hydrophobic functional group, and a composition for optical detection comprising the same. The surface-modified nanoparticles according to the present invention form clusters suitable for optical detection, for example, suitable as an X-ray contrast agent, and have surface plasmon energy in the visible region, thereby being usefully applied to a variety of optical detection methods.
• US8753895B2
  申请人：——

  公开号：US8753895B2

  公开（公告）日：2014-06-17