HCID66631405

2-Bromo-N-(4-fluorobenzyl)-4-methylthiazole-5-carboxamide

2-bromo-N-[(4-fluorophenyl)methyl]-4-methyl-1,3-thiazole-5-carboxamide

C12H10BrFN2OS329.19 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1nc(Br)sc1C(=O)NCc1ccc(F)cc1
InChIKey: CQTRKGSINIWSNH-UHFFFAOYSA-N
分子式: C12H10BrFN2OS
平均分子量: 329.19 g/mol
单同位素质量: 327.96812

COMPUTED

结构计算性质

已同步

XLogP: 3.6
极性表面积: 70.2 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 3
重原子: 18
形式电荷: 0
复杂度: 300

ALIASES

名称与别名

共 6 条

2-Bromo-N-(4-fluorobenzyl)-4-methylthiazole-5-carboxamide1009378-33-9SCHEMBL244641CQTRKGSINIWSNH-UHFFFAOYSA-NDB-3649162-bromo-4-methyl-thiazole-5-carboxylic acid 4-fluoro-benzylamide

REACTIONS

参与反应

19 条

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

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uspto-grants-2011_11 · 10.6084/m9.figshare.5104873.v1 · US08063084B2

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uspto-grants-2011_11 · 10.6084/m9.figshare.5104873.v1 · US08063084B2

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Training data from https://doi.org/10.1039/C8SC04228D (1/10) · 10.1039/C8SC04228D

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