4-[7-[4-[5-(2-Aminoethenyl)-6-methyl-5,6-dihydropyrrolo[3,2-b]pyrrol-1-ium-4-yl]-2,6-dimethylcyclohexa-1,3-dien-1-yl]-2-[2,6-dimethyl-4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(13),3,5,9-tetraen-8-yl)cyclohexa-1,3-dien-1-yl]-9-(4-ethylphenyl)-1,9a-dihydrofluoren-9-yl]phenol

• 分子结构分类: 有机化合物 - 苯类化合物 - 芴
• 英文名称: 4-[7-[4-[5-(2-Aminoethenyl)-6-methyl-5,6-dihydropyrrolo[3,2-b]pyrrol-1-ium-4-yl]-2,6-dimethylcyclohexa-1,3-dien-1-yl]-2-[2,6-dimethyl-4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(13),3,5,9-tetraen-8-yl)cyclohexa-1,3-dien-1-yl]-9-(4-ethylphenyl)-1,9a-dihydrofluoren-9-yl]phenol
• 英文别名: 4-[7-[4-[5-(2-aminoethenyl)-6-methyl-5,6-dihydropyrrolo[3,2-b]pyrrol-1-ium-4-yl]-2,6-dimethylcyclohexa-1,3-dien-1-yl]-2-[2,6-dimethyl-4-(4,8,12-triazatricyclo[7.4.0.02,7]trideca-1(13),3,5,9-tetraen-8-yl)cyclohexa-1,3-dien-1-yl]-9-(4-ethylphenyl)-1,9a-dihydrofluoren-9-yl]phenol
• 化学式: C62H63N6O+
• 分子量: 908.2
• InChiKey: XQDMDVSGAYBXSR-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  11.11
• 重原子数：
  69
• 可旋转键数：
  8
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  78.1
• 氢给体数：
  3
• 氢受体数：
  6