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1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone

更新时间:2025-08-25 17:01:59

1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone结构式
1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone结构式
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常用名 1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone 英文名 1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone
CAS号 55687-76-8 分子量 302.32800
密度 1.262g/cm3 沸点 589.3ºC at 760 mmHg
分子式 C15H18N4O3 熔点 N/A
MSDS N/A 闪点 310.2ºC

 名称

英文名 1-[4-[(2,4-diaminopyrimidin-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone

 物理化学性质

密度 1.262g/cm3
沸点 589.3ºC at 760 mmHg
分子式 C15H18N4O3
分子量 302.32800
闪点 310.2ºC
精确质量 302.13800
PSA 114.81000
LogP 1.31180
InChIKey RYAPRJDMWXYXKI-UHFFFAOYSA-N
SMILES COc1cc(Cc2cnc(N)nc2N)cc(OC)c1C(C)=O
折射率 1.615

 合成线路

~57%

1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone结构式

1-[4-[(2,4-Diam...

55687-76-8

文献:Kompis; Then; Boehni; et al. European Journal of Medicinal Chemistry, 1980 , vol. 15, # 1 p. 17 - 22

~%

1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone结构式

1-[4-[(2,4-Diam...

55687-76-8

文献:Kompis; Then; Boehni; et al. European Journal of Medicinal Chemistry, 1980 , vol. 15, # 1 p. 17 - 22

~%

1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone结构式

1-[4-[(2,4-Diam...

55687-76-8

文献:Kompis; Then; Boehni; et al. European Journal of Medicinal Chemistry, 1980 , vol. 15, # 1 p. 17 - 22

~%

1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone结构式

1-[4-[(2,4-Diam...

55687-76-8

文献:Kompis; Then; Boehni; et al. European Journal of Medicinal Chemistry, 1980 , vol. 15, # 1 p. 17 - 22

~%

1-[4-[(2,4-Diaminopyrimidine-5-yl)methyl]-2,6-dimethoxyphenyl]ethanone结构式

1-[4-[(2,4-Diam...

55687-76-8

文献:Kompis; Then; Boehni; et al. European Journal of Medicinal Chemistry, 1980 , vol. 15, # 1 p. 17 - 22

 靶点实验

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实验名称:The concentration required to inhibit dihydrofolate reductase in rat liver
来源:ChEMBL
靶标:Dihydrofolate reductase
External Id:CHEMBL666235
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