[5,6-Dichloro-2-[3-[5,6-dichloro-1-ethyl-3-(sulfonatomethyl)benzimidazol-3-ium-2-yl]prop-2-enylidene]-3-ethylbenzimidazol-1-yl]methanesulfonate;[2-[[5,5-dimethyl-3-[[3-(sulfonatomethyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]cyclohexen-1-yl]methylidene]-1,3-benzothiazol-3-yl]methanesulfonate;[1-ethyl-2-[5-[1-ethyl-3-(sulfonatomethyl)benzo[f]benzimidazol-3-ium-2-yl]penta-2,4-dienylidene]benzo[f]benzimidazol-3-yl]methanesulfonate;[3-methyl-2-[5-[1-methyl-3-(sulfonatomethyl)imidazo[4,5-b]quinoxalin-2-ylidene]penta-1,3-dienyl]imidazo[4,5-b]quinoxalin-3-ium-1-yl]methanesulfonate

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: [5,6-Dichloro-2-[3-[5,6-dichloro-1-ethyl-3-(sulfonatomethyl)benzimidazol-3-ium-2-yl]prop-2-enylidene]-3-ethylbenzimidazol-1-yl]methanesulfonate;[2-[[5,5-dimethyl-3-[[3-(sulfonatomethyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]cyclohexen-1-yl]methylidene]-1,3-benzothiazol-3-yl]methanesulfonate;[1-ethyl-2-[5-[1-ethyl-3-(sulfonatomethyl)benzo[f]benzimidazol-3-ium-2-yl]penta-2,4-dienylidene]benzo[f]benzimidazol-3-yl]methanesulfonate;[3-methyl-2-[5-[1-methyl-3-(sulfonatomethyl)imidazo[4,5-b]quinoxalin-2-ylidene]penta-1,3-dienyl]imidazo[4,5-b]quinoxalin-3-ium-1-yl]methanesulfonate
• 英文别名: [5,6-dichloro-2-[3-[5,6-dichloro-1-ethyl-3-(sulfonatomethyl)benzimidazol-3-ium-2-yl]prop-2-enylidene]-3-ethylbenzimidazol-1-yl]methanesulfonate;[2-[[5,5-dimethyl-3-[[3-(sulfonatomethyl)-1,3-benzothiazol-3-ium-2-yl]methylidene]cyclohexen-1-yl]methylidene]-1,3-benzothiazol-3-yl]methanesulfonate;[1-ethyl-2-[5-[1-ethyl-3-(sulfonatomethyl)benzo[f]benzimidazol-3-ium-2-yl]penta-2,4-dienylidene]benzo[f]benzimidazol-3-yl]methanesulfonate;[3-methyl-2-[5-[1-methyl-3-(sulfonatomethyl)imidazo[4,5-b]quinoxalin-2-ylidene]penta-1,3-dienyl]imidazo[4,5-b]quinoxalin-3-ium-1-yl]methanesulfonate
• 化学式: C109H100Cl4N18O24S10-4
• 分子量: 2508.5
• InChiKey: SGEKBCAWLCBUDS-UHFFFAOYSA-J

计算性质

• 辛醇/水分配系数(LogP)：
  16.29
• 重原子数：
  165
• 可旋转键数：
  22
• 环数：
  21.0
• sp3杂化的碳原子比例：
  0.21
• 拓扑面积：
  683
• 氢给体数：
  0
• 氢受体数：
  37