HCID23037316

2-(3-Chlorophenyl)-3-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]3H-imidazo[4,5-b]pyridine fumarate

(E)-but-2-enedioic acid;2-[2-(3-chlorophenyl)imidazo[4,5-b]pyridin-3-yl]-1-(4-methylpiperazin-1-yl)ethanone

C23H24ClN5O5485.9 g/mol

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IDENTITY

结构与身份

标准SMILES: CN1CCN(C(=O)Cn2c(-c3cccc(Cl)c3)nc3cccnc32)CC1.O=C(O)/C=C/C(=O)O
InChIKey: GKVRROJZUJIEDH-WLHGVMLRSA-N
分子式: C23H24ClN5O5
平均分子量: 485.9 g/mol
单同位素质量: 485.1465966

COMPUTED

结构计算性质

已同步

极性表面积: 129 Å²
氢键供体: 2
氢键受体: 8
可旋转键: 5
重原子: 34
形式电荷: 0
复杂度: 617

ALIASES

名称与别名

共 4 条

SCHEMBL10387418GKVRROJZUJIEDH-WLHGVMLRSA-N2-(3-Chlorophenyl)-3-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]-3H-imidazo[4,5-b]pyridine fumarate2-(3-Chlorophenyl)-3-[2-(4-methyl-1-piperazinyl)-2-oxoethyl]3H-imidazo[4,5-b]pyridine fumarate

REACTIONS

参与反应

4 条

uspto-grants-1989_04 · 10.6084/m9.figshare.5104873.v1 · US04824951

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uspto-grants-1988_09 · 10.6084/m9.figshare.5104873.v1 · US04772600

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uspto-grants-1990_08 · 10.6084/m9.figshare.5104873.v1 · US04948800

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uspto-grants-1990_04 · 10.6084/m9.figshare.5104873.v1 · US04914109

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