3-[[6-(dimethylamino)purin-9-yl]methyl]benzonitrile

• 常用名: 3-[[6-(dimethylamino)purin-9-yl]methyl]benzonitrile
• 英文名: 3-[[6-(dimethylamino)purin-9-yl]methyl]benzonitrile
• CAS号: 112089-20-0
• 分子量: 278.31200
• 密度: 1.26g/cm3
• 沸点: 516.6ºC at 760 mmHg
• 分子式: C₁₅H₁₄N₆
• 熔点: N/A
• 闪点: 266.2ºC

名称

• 英文名: 3-[[6-(dimethylamino)purin-9-yl]methyl]benzonitrile

物理化学性质

• 密度: 1.26g/cm3
• 沸点: 516.6ºC at 760 mmHg
• 分子式: C₁₅H₁₄N₆
• 分子量: 278.31200
• 闪点: 266.2ºC
• 精确质量: 278.12800
• PSA: 70.63000
• LogP: 1.81228
• InChIKey: MFLLVVOSNHPNDS-UHFFFAOYSA-N
• SMILES: CN(C)c1ncnc2c1ncn2Cc1cccc(C#N)c1
• 蒸汽压: 8.86E-11mmHg at 25°C
• 折射率: 1.677

靶点实验

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实验名称：Ability to protect Sprague-Dawley male rats against maximal electroshock-induced seiz... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL788380

实验名称：Ability of intraperitoneally administered compound to antagonise apomorphine-induced ... 来源：ChEMBL 靶标：Rattus norvegicus External Id：CHEMBL884651

实验名称：The percent inhibition of [3H]diazepam binding to the benzodiazepine receptor of rat ... 来源：ChEMBL 靶标：Gamma-aminobutyric acid receptor subunit alpha-3 External Id：CHEMBL650284

实验名称：In vitro activity against rhinovirus type 1B was determined by plaque inhibition assa... 来源：ChEMBL 靶标：rhinovirus A1B External Id：CHEMBL804249

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英文别名

• Benzonitrile,3-((6-(dimethylamino)-9H-purin-9-yl)methyl)
• 6-(Dimethylamino)-9-(3-cyanobenzyl)-9H-purine