HCID22040593

(4-{2-[(4-bromophenyl)methyl]-1-methylbenzimidazol-5-yloxy)-(2-pyridyl))-N-methylcarboxamide

4-[2-[(4-bromophenyl)methyl]-1-methylbenzimidazol-5-yl]oxy-N-methylpyridine-2-carboxamide

C22H19BrN4O2451.3 g/mol

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IDENTITY

结构与身份

标准SMILES: CNC(=O)c1cc(Oc2ccc3c(c2)nc(Cc2ccc(Br)cc2)n3C)ccn1
InChIKey: LGXPXEHAKCAUEV-UHFFFAOYSA-N
分子式: C22H19BrN4O2
平均分子量: 451.3 g/mol
单同位素质量: 450.06914

COMPUTED

结构计算性质

已同步

XLogP: 4.2
极性表面积: 69 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 5
重原子: 29
形式电荷: 0
复杂度: 557

ALIASES

名称与别名

共 4 条

SCHEMBL2886979LGXPXEHAKCAUEV-UHFFFAOYSA-N(4-{2-[(4-bromophenyl)methyl]-1-methylbenzimidazol-5-yloxy)-(2-pyridyl))-N-methylcarboxamide[4-{2-[(4-bromophenyl)methyl]-1-methylbenzimidazol-5-yloxy}(2-pyridyl)]-n-methylcarboxamide

REACTIONS

参与反应

4 条

uspto-grants-2010_06 · 10.6084/m9.figshare.5104873.v1 · US07728010B2

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uspto-grants-2006_07 · 10.6084/m9.figshare.5104873.v1 · US07071216B2

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uspto-grants-2013_12 · 10.6084/m9.figshare.5104873.v1 · US08614330B2

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uspto-grants-2012_10 · 10.6084/m9.figshare.5104873.v1 · US08299108B2

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