HCID46848914

1-[4-(3,4-Difluoro-1H-pyrrol-1-yl)-2-fluorophenyl]-5-methoxy-3-(1-phenyl-1H-pyrazol-5-yl)pyridazin-4(1H)-one

1-[4-(3,4-difluoropyrrol-1-yl)-2-fluorophenyl]-5-methoxy-3-(2-phenylpyrazol-3-yl)pyridazin-4-one

C24H16F3N5O2463.4 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1cn(-c2ccc(-n3cc(F)c(F)c3)cc2F)nc(-c2ccnn2-c2ccccc2)c1=O
InChIKey: DUVTYDUZPQTGFG-UHFFFAOYSA-N
分子式: C24H16F3N5O2
平均分子量: 463.4 g/mol
单同位素质量: 463.12560926

COMPUTED

结构计算性质

已同步

XLogP: 4.4
极性表面积: 64.7 Å²
氢键供体: 0
氢键受体: 8
可旋转键: 5
重原子: 34
形式电荷: 0
复杂度: 810

ALIASES

名称与别名

共 4 条

SCHEMBL519127SCHEMBL30123639DUVTYDUZPQTGFG-UHFFFAOYSA-N1-[4-(3,4-Difluoro-1H-pyrrol-1-yl)-2-fluorophenyl]-5-methoxy-3-(1-phenyl-1H-pyrazol-5-yl)pyridazin-4(1H)-one

REACTIONS

参与反应

5 条

uspto-grants-2014_12 · 10.6084/m9.figshare.5104873.v1 · US08916566B2

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uspto-grants-2014_07 · 10.6084/m9.figshare.5104873.v1 · US08778944B2

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uspto-grants-2013_01 · 10.6084/m9.figshare.5104873.v1 · US08354411B2

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uspto-grants-2013_08 · 10.6084/m9.figshare.5104873.v1 · US08513251B2

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uspto-grants-2013_05 · 10.6084/m9.figshare.5104873.v1 · US08435995B2

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