3-Tert-butyl-1-methyl-5-methylsulfanylpyrazole

• 分子结构分类: 有机化合物 - 有机硫化合物 - 硫醚类
• 英文名称: 3-Tert-butyl-1-methyl-5-methylsulfanylpyrazole
• 化学式: C₉H₁₆N₂S
• mdl: MFCD01566249
• 分子量: 184.3
• InChiKey: WSWBYABCPTXXRZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.8
• 重原子数：
  12
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.666
• 拓扑面积：
  43.1
• 氢给体数：
  0
• 氢受体数：
  2

文献信息

• Chemical Synthesis of a Highly Potent Epothilone
  申请人：Nicolaou Kyriacos C.

  公开号：US20080293747A1

  公开（公告）日：2008-11-27

  A highly active synthetic epothilone compound whose activity exceeds that of either epothilone EpoA or EpoB when assayed as a cytotoxic agent against a cancer cell line is disclosed as is a pharmaceutical composition containing the synthetic epothilone.
• CHEMICAL SYNTHESIS OF A HIGHLY POTENT EPOTHILONE
  申请人：Nicolaou Kyriacos C.

  公开号：US20110301183A1

  公开（公告）日：2011-12-08

  A highly active synthetic epothilone compound whose activity exceeds that of either epothilone EpoA or EpoB when assayed as a cytotoxic agent against a cancer cell line is disclosed as is a pharmaceutical composition containing the synthetic epothilone.
• US8003801B2
  申请人：——

  公开号：US8003801B2

  公开（公告）日：2011-08-23