7-[[2-(Carbamoylamino)-4-[[4-[4-[2-[[4-[3-(carbamoylamino)-4-[(3-methyl-6,8-disulfonaphthalen-2-yl)diazenyl]anilino]-6-chloro-1,3,5-triazin-2-yl]amino]ethyl]piperazin-1-yl]-6-chloro-1,3,5-triazin-2-yl]amino]phenyl]diazenyl]-3-methylnaphthalene-1,6-disulfonic acid;7-[[2-(carbamoylamino)-4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]-3-methylnaphthalene-1,6-disulfonic acid

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: 7-[[2-(Carbamoylamino)-4-[[4-[4-[2-[[4-[3-(carbamoylamino)-4-[(3-methyl-6,8-disulfonaphthalen-2-yl)diazenyl]anilino]-6-chloro-1,3,5-triazin-2-yl]amino]ethyl]piperazin-1-yl]-6-chloro-1,3,5-triazin-2-yl]amino]phenyl]diazenyl]-3-methylnaphthalene-1,6-disulfonic acid;7-[[2-(carbamoylamino)-4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]-3-methylnaphthalene-1,6-disulfonic acid
• 英文别名: 7-[[2-(carbamoylamino)-4-[[4-[4-[2-[[4-[3-(carbamoylamino)-4-[(3-methyl-6,8-disulfonaphthalen-2-yl)diazenyl]anilino]-6-chloro-1,3,5-triazin-2-yl]amino]ethyl]piperazin-1-yl]-6-chloro-1,3,5-triazin-2-yl]amino]phenyl]diazenyl]-3-methylnaphthalene-1,6-disulfonic acid;7-[[2-(carbamoylamino)-4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]diazenyl]-3-methylnaphthalene-1,6-disulfonic acid
• 化学式: C69H61Cl4N27O21S6
• 分子量: 1938.6
• InChiKey: ZBXGWXDQLSIOOV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.59
• 重原子数：
  127
• 可旋转键数：
  26
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  787
• 氢给体数：
  16
• 氢受体数：
  42