HCID23082609

(2,3,4-Trimethoxy-6-methylphenyl)(2-fluoro-4-iodo-5-methyl-3-pyridyl)methanol

(2-fluoro-4-iodo-5-methyl-3-pyridinyl)-(2,3,4-trimethoxy-6-methylphenyl)methanol

C17H19FINO4447.24 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1cc(C)c(C(O)c2c(F)ncc(C)c2I)c(OC)c1OC
InChIKey: TUVZYKGMRLDFAR-UHFFFAOYSA-N
分子式: C17H19FINO4
平均分子量: 447.24 g/mol
单同位素质量: 447.03428

COMPUTED

结构计算性质

已同步

XLogP: 3.4
极性表面积: 60.8 Å²
氢键供体: 1
氢键受体: 6
可旋转键: 5
重原子: 24
形式电荷: 0
复杂度: 405

ALIASES

名称与别名

共 4 条

SCHEMBL676686TUVZYKGMRLDFAR-UHFFFAOYSA-N(2,3,4,-trimethoxy-6-methylphenyl) (2-fluoro-4-iodo-5-methyl-3-pyridyl)methanol(2,3,4-trimethoxy-6-methylphenyl)(2-fluoro-4-iodo-5-methyl-3-pyridyl)methanol

REACTIONS

相关反应

8 条

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

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uspto-grants-2014_02 · 10.6084/m9.figshare.5104873.v1 · US08653113B2

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uspto-grants-2014_02 · 10.6084/m9.figshare.5104873.v1 · US08653113B2

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uspto-grants-2014_02 · 10.6084/m9.figshare.5104873.v1 · US08653277B2

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uspto-grants-2014_02 · 10.6084/m9.figshare.5104873.v1 · US08653277B2

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uspto-grants-2013_12 · 10.6084/m9.figshare.5104873.v1 · US08609150B2

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uspto-grants-2013_12 · 10.6084/m9.figshare.5104873.v1 · US08609150B2

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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D

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