名称: methyl 2-[[3-[2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)pyrimidin-1-yl]phenoxy]-2-pyridinyl]oxy]acetate
SMILES:
CN1C(=CC(=O)N(C1=O)C2=CC(=C(C=C2F)Cl)OC3=C(N=CC=C3)OCC(=O)OC)C(F)(F)F分子加工
分子式
C20H14ClF4N3O6
分子量
503.79
精确质量
503.0507
XLogP
3.09
TPSA
101.65
氢键给体数
0
氢键受体数
7
可旋转键
6
重原子数
34
环数
3
芳香环
3
饱和环
0
脂环
0
立体中心
0
未定义立体
0
形式电荷
0
杂原子数
14
共价单元
1
sp3占比
0.2
摩尔折射率
109.07
补充信息
InChIKey: ZSUQPCWEESFLBV-UHFFFAOYSA-N
同义词
3-[2-chloro-4-fluoro-5-(3-methyl-2,6-dioxo-4-trifluoromethyl-1,2,3,6-tetrahydropyrimidin-1-yl)phenoxy]-2-(methoxycarbonylmethoxy)pyridineSCHEMBL38255483-{2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-(methoxycarbonyl)methoxypyridinemethyl [3-{2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrah ydropyrimidin-1-yl]phenoxy}-2-pyridyloxy]acetatemethyl [3-{2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-pyridyloxy]-acetatemethyl [3-{2-chloro-4-fluoro-5-[3-methyl-2,6-dioxo-4-(trifluoromethyl)-1,2,3,6-tetrahydropyrimidin-1-yl]phenoxy}-2-pyridyloxy]acetate
参与 28 个反应→