HCID23145839

4-Methyl-3-[4-(5-pyrimidinyl)pyrimidin-2-ylamino]aniline

4-methyl-3-N-(4-pyrimidin-5-ylpyrimidin-2-yl)benzene-1,3-diamine

C15H14N6278.31 g/molCAS 641615-36-3

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IDENTITY

结构与身份

标准SMILES: Cc1ccc(N)cc1Nc1nccc(-c2cncnc2)n1
InChIKey: BECLORGBMXGXCB-UHFFFAOYSA-N
分子式: C15H14N6
平均分子量: 278.31 g/mol
单同位素质量: 278.12799447

COMPUTED

结构计算性质

等待补全

XLogP: 1.7
极性表面积: 89.6 Å²
氢键供体: 2
氢键受体: 6
可旋转键: 3
重原子: 21
形式电荷: 0
复杂度: 319

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 13 条

641615-36-34-methyl-3-[4-(5-pyrimidinyl)pyrimidin-2-ylamino]anilineN*3*-[4,5']BIPYRIMIDINYL-2-YL-4-METHYL-BENZENE-1,3-DIAMINE4-methyl-3-N-(4-pyrimidin-5-ylpyrimidin-2-yl)benzene-1,3-diamineSCHEMBL2575958DTXSID80630980BECLORGBMXGXCB-UHFFFAOYSA-NSB17864DA-41820N(3)-4,5'-bipyrimidin-2-yl-4-methyl benzene-1,3-diamineN(3)-4,5'-Bipyrimidin-2-yl-4-methylbenzene-1,3-diamineN~3~-([4,5'-Bipyrimidin]-2-yl)-4-methylbenzene-1,3-diamineN1-([4,5'-Bipyrimidin]-2-yl)-6-methylbenzene-1,3-diamine

REACTIONS

参与反应

11 条

uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07728131B2

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uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07728131B2

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uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07728131B2

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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