1-(4-Chloro-2-fluoro-5-methylphenyl)imino-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-3-one;1-(4,6-dimethylpyrimidin-2-yl)-3-[2-(oxetan-3-ylmethyl)phenyl]sulfonylurea;(2-methyl-1-oxo-1-prop-2-enoxypropan-2-yl) 2-chloro-5-(3,4-dimethyl-2,6-dioxopyrimidin-1-yl)benzoate

• 分子结构分类: 有机化合物 - 有机氮化合物
• 英文名称: 1-(4-Chloro-2-fluoro-5-methylphenyl)imino-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-3-one;1-(4,6-dimethylpyrimidin-2-yl)-3-[2-(oxetan-3-ylmethyl)phenyl]sulfonylurea;(2-methyl-1-oxo-1-prop-2-enoxypropan-2-yl) 2-chloro-5-(3,4-dimethyl-2,6-dioxopyrimidin-1-yl)benzoate
• 英文别名: 1-(4-chloro-2-fluoro-5-methylphenyl)imino-5,6,7,8-tetrahydro-[1,3,4]thiadiazolo[3,4-a]pyridazin-3-one;1-(4,6-dimethylpyrimidin-2-yl)-3-[2-(oxetan-3-ylmethyl)phenyl]sulfonylurea;(2-methyl-1-oxo-1-prop-2-enoxypropan-2-yl) 2-chloro-5-(3,4-dimethyl-2,6-dioxopyrimidin-1-yl)benzoate
• 化学式: C50H54Cl2FN9O11S2
• 分子量: 1111.1
• InChiKey: DNIHEJQUTNYADM-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  6.79
• 重原子数：
  75
• 可旋转键数：
  14
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.34
• 拓扑面积：
  273
• 氢给体数：
  2
• 氢受体数：
  16