2,4,6-tribromo-1-N,3-N,3-N-tris(2,3,4,5,6-pentahydroxyhexyl)-1-N-(2,3,4,6-tetrahydroxy-5-methylhexyl)-5-[[2-[[4-[10,15,20-tris[4-[[2-[3,5-bis[bis(2,3,4,5,6-pentahydroxyhexyl)carbamoyl]-2,4,6-tribromoanilino]-2-oxoethyl]sulfamoyl]phenyl]-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24-tetracosahydroporphyrin-5-yl]phenyl]sulfonylamino]acetyl]amino]benzene-1,3-dicarboxamide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 四吡咯及其衍生物
• 英文名称: 2,4,6-tribromo-1-N,3-N,3-N-tris(2,3,4,5,6-pentahydroxyhexyl)-1-N-(2,3,4,6-tetrahydroxy-5-methylhexyl)-5-[[2-[[4-[10,15,20-tris[4-[[2-[3,5-bis[bis(2,3,4,5,6-pentahydroxyhexyl)carbamoyl]-2,4,6-tribromoanilino]-2-oxoethyl]sulfamoyl]phenyl]-1,2,3,4,5,6,7,8,9,10,11,12,13,14,15,16,17,18,19,20,21,22,23,24-tetracosahydroporphyrin-5-yl]phenyl]sulfonylamino]acetyl]amino]benzene-1,3-dicarboxamide
• 化学式: C₁₈₁H₂₇₄Br₁₂N₂₀O₉₉S₄
• 分子量: 5401.0
• InChiKey: PKGJRDVACGWKHZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -37.9
• 重原子数：
  316
• 可旋转键数：
  128
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.67
• 拓扑面积：
  2140
• 氢给体数：
  91
• 氢受体数：
  107