(2S,11S,19aS)-2-(diethylamino)-15-fluoro-N,7,12-trimethyl-5,8,13-trioxo-2,3,6,7,8,9,10,11,12,13,19,19a-dodecahydro-1H,5H-pyrrolo[2,1-c][1,4,7,12]benzoxatriazacyclopentadecine-11-carboxamide trifluoroacetic acid | 1264226-93-8

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: (2S,11S,19aS)-2-(diethylamino)-15-fluoro-N,7,12-trimethyl-5,8,13-trioxo-2,3,6,7,8,9,10,11,12,13,19,19a-dodecahydro-1H,5H-pyrrolo[2,1-c][1,4,7,12]benzoxatriazacyclopentadecine-11-carboxamide trifluoroacetic acid
• 英文别名: (2S,11S,19aS)-2-(diethylamino)-15-fiuoro-N,7,12-trimethyl-5,8,13-trioxo-2,3,6,7,8,9,10,11,12,13,19,19a-dodecahydro-1H,5H-pyrrolo[2,1-c][1,4,7,12]benzoxatriazacyciopentadecine-11-carboxamide trifluoroacetate；(2S,11S,19aS)-2-(diethylamino)-15-fluoro-N,7,12-trimethyl-5,8,13-trioxo-2,3,6,7,8,9,10,11,12,13,19,19a-dodecahydro-1H,5H-pyrrolo[2,1-c][1,4,7,12]benzoxatriazacyclopentadecine-11-carboxamide trifluoroacetate
• CAS: 1264226-93-8
• 化学式: C₂HF₃O₂*C₂₆H₃₈FN₅O₅
• 分子量: 633.641
• InChiKey: HZZKQDQWUCIXDA-JFJRDDEKSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.59
• 重原子数：
  44.0
• 可旋转键数：
  4.0
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  139.8
• 氢给体数：
  2.0
• 氢受体数：
  7.0