4-[7,7-Bis(8-bromooctyl)-10-[[4-(7,7-dimethyl-10-phenyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)-2,1,3-benzothiadiazol-7-yl]methyl]-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,1,3-benzothiadiazole

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻二唑类
• 英文名称: 4-[7,7-Bis(8-bromooctyl)-10-[[4-(7,7-dimethyl-10-phenyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)-2,1,3-benzothiadiazol-7-yl]methyl]-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,1,3-benzothiadiazole
• 英文别名: 4-[7,7-bis(8-bromooctyl)-10-[[4-(7,7-dimethyl-10-phenyl-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl)-2,1,3-benzothiadiazol-7-yl]methyl]-3,11-dithiatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraen-4-yl]-7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-2,1,3-benzothiadiazole
• 化学式: C₆₁H₆₅BBr₂N₄O₂S₆
• 分子量: 1249.2
• InChiKey: QIVZVGYWNACATI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  19.66
• 重原子数：
  76
• 可旋转键数：
  22
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  240
• 氢给体数：
  0
• 氢受体数：
  12