HCID69353472

N-(5-Bromo-6-methyl-2-pyridyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]-2,5-dimethylphenyl}urea

1-(5-bromo-6-methyl-2-pyridinyl)-3-[4-(6,7-dimethoxyquinolin-4-yl)oxy-2,5-dimethylphenyl]urea

C26H25BrN4O4537.4 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1cc2nccc(Oc3cc(C)c(NC(=O)Nc4ccc(Br)c(C)n4)cc3C)c2cc1OC
InChIKey: HDVZKPKOHFOVGI-UHFFFAOYSA-N
分子式: C26H25BrN4O4
平均分子量: 537.4 g/mol
单同位素质量: 536.10592

COMPUTED

结构计算性质

等待补全

XLogP: 5.3
极性表面积: 94.6 Å²
氢键供体: 2
氢键受体: 6
可旋转键: 6
重原子: 35
形式电荷: 0
复杂度: 702

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 4 条

SCHEMBL5208287HDVZKPKOHFOVGI-UHFFFAOYSA-NN-(5 -Bromo-6-methyl-2-pyridyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl) oxy]-2,5-dimethylphenyl}ureaN-(5-Bromo-6-methyl-2-pyridyl)-N'-{4-[(6,7-dimethoxy-4-quinolyl)oxy]-2,5-dimethylphenyl}urea

REACTIONS

参与反应

3 条

Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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uspto-grants-2004_09 · 10.6084/m9.figshare.5104873.v1 · US06797823B1

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uspto-grants-2007_01 · 10.6084/m9.figshare.5104873.v1 · US07169789B2

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