4-[[3,8-Dimethyl-6-[2-(14-prop-1-ynyl-3-nonacyclo[14.6.6.65,12.02,15.04,13.06,11.017,22.023,28.029,34]tetratriaconta-2(15),3,6,8,10,13,17,19,21,23,25,27,29,31,33-pentadecaenyl)ethynyl]-2,4-dihydrothieno[3,4-b][1,4]dioxepin-3-yl]methoxymethyl]-1-methyltriazole

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 4-[[3,8-Dimethyl-6-[2-(14-prop-1-ynyl-3-nonacyclo[14.6.6.65,12.02,15.04,13.06,11.017,22.023,28.029,34]tetratriaconta-2(15),3,6,8,10,13,17,19,21,23,25,27,29,31,33-pentadecaenyl)ethynyl]-2,4-dihydrothieno[3,4-b][1,4]dioxepin-3-yl]methoxymethyl]-1-methyltriazole
• 英文别名: 4-[[3,8-dimethyl-6-[2-(14-prop-1-ynyl-3-nonacyclo[14.6.6.65,12.02,15.04,13.06,11.017,22.023,28.029,34]tetratriaconta-2(15),3,6,8,10,13,17,19,21,23,25,27,29,31,33-pentadecaenyl)ethynyl]-2,4-dihydrothieno[3,4-b][1,4]dioxepin-3-yl]methoxymethyl]-1-methyltriazole
• 化学式: C₅₃H₄₁N₃O₃S
• 分子量: 800.0
• InChiKey: WNJHKKQLAOYIHL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.1
• 重原子数：
  60
• 可旋转键数：
  7
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  86.6
• 氢给体数：
  0
• 氢受体数：
  6