HCID71105564

6-(3-Chloro-phenyl)-5-methyl-pyridine-2-carboxylic acid (1-methyl-1-oxazol-2-yl-ethyl)-amide

6-(3-chlorophenyl)-5-methyl-N-[2-(1,3-oxazol-2-yl)propan-2-yl]pyridine-2-carboxamide

C19H18ClN3O2355.8 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1ccc(C(=O)NC(C)(C)c2ncco2)nc1-c1cccc(Cl)c1
InChIKey: BQYZFHUJUGUJIE-UHFFFAOYSA-N
分子式: C19H18ClN3O2
平均分子量: 355.8 g/mol
单同位素质量: 355.1087545

COMPUTED

结构计算性质

已同步

XLogP: 3.7
极性表面积: 68 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 4
重原子: 25
形式电荷: 0
复杂度: 474

ALIASES

名称与别名

共 6 条

CHEMBL3960112SCHEMBL14226192BQYZFHUJUGUJIE-UHFFFAOYSA-NBDBM210247US9290451, 496-(3-Chloro-phenyl)-5-methyl-pyridine-2-carboxylic acid (1-methyl-1-oxazol-2-yl-ethyl)-amide

REACTIONS

相关反应

3 条

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

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uspto-grants-2016_04 · 10.6084/m9.figshare.5104873.v1 · US09321727B2

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uspto-grants-2016_03 · 10.6084/m9.figshare.5104873.v1 · US09290451B2

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