HCID66577406

N-[1-(4-Bromo-phenyl)-cyclopropanecarbonyl]-methanesulfonamide

1-(4-bromophenyl)-N-methylsulfonylcyclopropane-1-carboxamide

C11H12BrNO3S318.19 g/mol

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IDENTITY

结构与身份

标准SMILES: CS(=O)(=O)NC(=O)C1(c2ccc(Br)cc2)CC1
InChIKey: MEVAITBPBRVVFM-UHFFFAOYSA-N
分子式: C11H12BrNO3S
平均分子量: 318.19 g/mol
单同位素质量: 316.97213

COMPUTED

结构计算性质

等待补全

XLogP: 1.7
极性表面积: 71.6 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 3
重原子: 17
形式电荷: 0
复杂度: 403

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 6 条

SCHEMBL2084MEVAITBPBRVVFM-UHFFFAOYSA-NDB-4066411-(4-Bromophenyl)-N-(methylsulfonyl)cyclopropanecarboxamideN-[1-(4-Bromo-phenyl)-cyclopropanecarbonyl]-methanesulfonamide1257214-56-4

REACTIONS

相关反应

10 条

uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08541587B2

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

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uspto-grants-2011_11 · 10.6084/m9.figshare.5104873.v1 · US08058300B2

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uspto-grants-2016_04 · 10.6084/m9.figshare.5104873.v1 · US09321738B2

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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uspto-grants-2014_03 · 10.6084/m9.figshare.5104873.v1 · US08664220B2

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uspto-grants-2012_07 · 10.6084/m9.figshare.5104873.v1 · US08217066B2

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uspto-grants-2015_07 · 10.6084/m9.figshare.5104873.v1 · US09090573B2

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