[(3aR,6S,6aR)-6-[4-[(3aR,6R,6aR)-6-hydroxy-2,2-dimethyl-5-[(4-methylphenyl)sulfonyloxymethyl]-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-yl]buta-1,3-diynyl]-6-hydroxy-2,2-dimethyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methyl 4-methylbenzenesulfonate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: [(3aR,6S,6aR)-6-[4-[(3aR,6R,6aR)-6-hydroxy-2,2-dimethyl-5-[(4-methylphenyl)sulfonyloxymethyl]-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-6-yl]buta-1,3-diynyl]-6-hydroxy-2,2-dimethyl-5,6a-dihydro-3aH-furo[2,3-d][1,3]dioxol-5-yl]methyl 4-methylbenzenesulfonate
• 化学式: C₃₄H₃₈O₁₄S₂
• 分子量: 734.8
• InChiKey: SEGLAAYYPOLUOG-RDJCTNQYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.9
• 重原子数：
  50
• 可旋转键数：
  11
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  199
• 氢给体数：
  2
• 氢受体数：
  14

文献信息

• [EN] SUBSTITUTED SUGAR DERIVED 1, 2, 3-TRIAZOLE COMPOUNDS AND THEIR DIMERS AND A PROCESS FOR THE PREPARATION THEREOF<br/>[FR] COMPOSÉS 1, 2, 3-TRIAZOLES DÉRIVÉS DE SUCRES SUBSTITUÉS ET LEURS DIMÈRES AINSI QU'UN PROCÉDÉ POUR LEUR PRÉPARATION
  申请人：COUNCIL SCIENT IND RES

  公开号：WO2014132273A1

  公开（公告）日：2014-09-04

  The present invention discloses tricyclic five membered sugar derived 1,2,3-triazoles compounds of formula I and their dimers and a process for the preparation thereof. Particularly, the present invention relates to tricyclic five membered sugar derived 1,2,3-triazoles compounds of formula I which are useful for screening of various kinases and other related targets. [Insert formula I here] wherein R is selected from hydrogen, (un)substituted or substituted alkyl, (un)substituted or substituted aryl, (un)substituted or substituted cycloalkyls, (un)substituted or substituted heteroaryls.