8-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione

• 常用名: 8-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione
• 英文名: 8-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione
• CAS号: 141807-96-7
• 分子量: 412.48200
• 密度: 1.2g/cm3
• 沸点: 616ºC at 760mmHg
• 分子式: C₂₂H₂₈N₄O₄
• 熔点: N/A
• 闪点: 326.3ºC

名称

• 英文名: 8-[(E)-2-(3,4-dimethoxyphenyl)ethenyl]-7-methyl-1,3-dipropylpurine-2,6-dione

物理化学性质

• 密度: 1.2g/cm3
• 沸点: 616ºC at 760mmHg
• 分子式: C₂₂H₂₈N₄O₄
• 分子量: 412.48200
• 闪点: 326.3ºC
• 精确质量: 412.21100
• PSA: 80.28000
• LogP: 2.90430
• InChIKey: UQGGPCQNHJCOPS-PKNBQFBNSA-N
• SMILES: CCCn1c(=O)c2c(nc(C=Cc3ccc(OC)c(OC)c3)n2C)n(CCC)c1=O
• 蒸汽压: 4.18E-15mmHg at 25°C
• 折射率: 1.587

靶点实验

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实验名称：Relative affinity for A1 and A2A adenosine receptors (shielded from light) 来源：ChEMBL 靶标：Adenosine receptors; A1 & A2a External Id：CHEMBL847327

实验名称：Ratio against A1 adenosine receptor to the A2 adenosine receptor (guinea pig forebrai... 来源：ChEMBL 靶标：N/A External Id：CHEMBL849651

实验名称：In vitro binding affinity against Adenosine A2a receptor in rat forebrain membranes b... 来源：ChEMBL 靶标：Adenosine receptor A2a External Id：CHEMBL647736

实验名称：Retention time in (R)-PIA) induced avoidance test (performed in mice) for antagonisti... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL720662

实验名称：Retention time in (R)-PIA) induced avoidance test (performed in mice) for antagonisti... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL719187

实验名称：Compound was tested in mouse catalepsy study (po); active at 1 mg/kg 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL838169

实验名称：Inhibitory activity on NECA-induced cyclic-AMP accumulation in CHO-K1 cells expressin... 来源：ChEMBL 靶标：Adenosine receptor A2b External Id：CHEMBL639472

实验名称：Retention time in (R)-PIA) induced avoidance test (performed in mice) for antagonisti... 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL719190

实验名称：Ratio between binding affinities for adenosine A1 and A2 receptor 来源：ChEMBL 靶标：Adenosine receptors; A1 & A2 External Id：CHEMBL850394

实验名称：Half life was determined 来源：ChEMBL 靶标：N/A External Id：CHEMBL639779

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