1-[3'-(1,2-Dihydroxyethyl)-11'-hydroxy-9'-(2-hydroxypropylamino)-19'-[5-(5-prop-1-ynylthiophen-2-yl)thiophene-2-carbonyl]spiro[cyclohexane-1,5'-tetracyclo[14.3.1.11,4.08,13]henicosa-8(13),9,11-trien-6-yne]-15'-yl]-2-methylguanidine

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 双噻吩和低聚噻吩
• 英文名称: 1-[3'-(1,2-Dihydroxyethyl)-11'-hydroxy-9'-(2-hydroxypropylamino)-19'-[5-(5-prop-1-ynylthiophen-2-yl)thiophene-2-carbonyl]spiro[cyclohexane-1,5'-tetracyclo[14.3.1.11,4.08,13]henicosa-8(13),9,11-trien-6-yne]-15'-yl]-2-methylguanidine
• 英文别名: 1-[3'-(1,2-dihydroxyethyl)-11'-hydroxy-9'-(2-hydroxypropylamino)-19'-[5-(5-prop-1-ynylthiophen-2-yl)thiophene-2-carbonyl]spiro[cyclohexane-1,5'-tetracyclo[14.3.1.11,4.08,13]henicosa-8(13),9,11-trien-6-yne]-15'-yl]-2-methylguanidine
• 化学式: C₄₅H₅₆N₄O₅S₂
• 分子量: 797.1
• InChiKey: HPFYVPMZKAJOFO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.9
• 重原子数：
  56
• 可旋转键数：
  11
• 环数：
  7.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  217
• 氢给体数：
  7
• 氢受体数：
  9