HCID25067308

2-bromo-5H-pyrrolo[2,3-b]pyrazine

C6H4BrN3198.02 g/molCAS 875781-43-4

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IDENTITY

结构与身份

标准SMILES: Brc1cnc2[nH]ccc2n1
InChIKey: KTKMLXBEBKGQGL-UHFFFAOYSA-N
分子式: C6H4BrN3
平均分子量: 198.02 g/mol
单同位素质量: 196.95886

COMPUTED

结构计算性质

已同步

XLogP: 1.4
极性表面积: 41.6 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 0
重原子: 10
形式电荷: 0
复杂度: 130

ALIASES

名称与别名

共 33 条

2-bromo-5H-pyrrolo[2,3-b]pyrazine875781-43-4DTXSID506486182-Bromo-5H-pyrrolo(2,3-b)pyrazineRefChem:257411DTXCID00599368851-148-55-BROMO-4,7-DIAZAINDOLEMFCD098348222-bromo-5H-pyrrolo[3,2-b]pyrazineCHEMBL36282475H-Pyrrolo[2,3-b]pyrazine, 2-bromo-4H-Pyrrolo[2,3-b]pyrazine, 2-bromo-TC8BC9REU8SCHEMBL421369SCHEMBL22980418SCHEMBL29414803KTKMLXBEBKGQGL-UHFFFAOYSA-NBDBM501270132-Bromo-4H-pyrrolo[2,3-b]pyrazine

REACTIONS

参与反应

75 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08822469B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846909B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846909B2

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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 (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 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 (6/10) · 10.1039/C8SC04228D

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