1-[14,19-Dihydroxy-2'-(hydroxymethyl)-19-methyl-6-[5-(5-prop-1-ynylthiophen-2-yl)thiophene-2-carbonyl]spiro[31-azaheptacyclo[16.8.5.12,5.15,9.121,25.012,29.015,30]tetratriaconta-12,14,16,21,23,25(32),29-heptaen-27-yne-3,1'-cyclopentane]-10-yl]-2-methylguanidine

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 1-[14,19-Dihydroxy-2'-(hydroxymethyl)-19-methyl-6-[5-(5-prop-1-ynylthiophen-2-yl)thiophene-2-carbonyl]spiro[31-azaheptacyclo[16.8.5.12,5.15,9.121,25.012,29.015,30]tetratriaconta-12,14,16,21,23,25(32),29-heptaen-27-yne-3,1'-cyclopentane]-10-yl]-2-methylguanidine
• 英文别名: 1-[14,19-dihydroxy-2'-(hydroxymethyl)-19-methyl-6-[5-(5-prop-1-ynylthiophen-2-yl)thiophene-2-carbonyl]spiro[31-azaheptacyclo[16.8.5.12,5.15,9.121,25.012,29.015,30]tetratriaconta-12,14,16,21,23,25(32),29-heptaen-27-yne-3,1'-cyclopentane]-10-yl]-2-methylguanidine
• 化学式: C₅₃H₅₈N₄O₄S₂
• 分子量: 879.2
• InChiKey: YBRJZCHXZOIZEF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  9.7
• 重原子数：
  63
• 可旋转键数：
  7
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  197
• 氢给体数：
  6
• 氢受体数：
  8