HCID42629932

Cyclopropanesulfonic acid methyl-[6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine-3-carbonyl]-amide

N-cyclopropylsulfonyl-N-methyl-6-[(5-methyl-3-phenyl-1,2-oxazol-4-yl)methoxy]pyridine-3-carboxamide

C21H21N3O5S427.5 g/mol

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IDENTITY

结构与身份

标准SMILES: Cc1onc(-c2ccccc2)c1COc1ccc(C(=O)N(C)S(=O)(=O)C2CC2)cn1
InChIKey: ZRNZCYYJCCIJJN-UHFFFAOYSA-N
分子式: C21H21N3O5S
平均分子量: 427.5 g/mol
单同位素质量: 427.12019195

COMPUTED

结构计算性质

等待补全

XLogP: 2.7
极性表面积: 111 Å²
氢键供体: 0
氢键受体: 7
可旋转键: 7
重原子: 30
形式电荷: 0
复杂度: 702

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 6 条

SCHEMBL2930574CHEMBL3681533ZRNZCYYJCCIJJN-UHFFFAOYSA-NBDBM133544US8846719, 236Cyclopropanesulfonic acid methyl-[6-(5-methyl-3-phenyl-isoxazol-4-ylmethoxy)-pyridine-3-carbonyl]-amide

REACTIONS

相关反应

6 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846719B2

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

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uspto-grants-2014_11 · 10.6084/m9.figshare.5104873.v1 · US08877782B2

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uspto-grants-2014_11 · 10.6084/m9.figshare.5104873.v1 · US08877783B2

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uspto-grants-2015_07 · 10.6084/m9.figshare.5104873.v1 · US09073908B2

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uspto-grants-2013_08 · 10.6084/m9.figshare.5104873.v1 · US08518974B2

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