4-Cyano-N-(6-fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)benzenesulfonamide

• 常用名: 4-Cyano-N-(6-fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)benzenesulfonamide
• 英文名: 4-Cyano-N-(6-fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)benzenesulfonamide
• CAS号: 2153479-74-2
• 分子量: 343.3
• 密度: N/A
• 沸点: N/A
• 分子式: C₁₆H₁₀FN₃O₃S
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: 4-Cyano-N-(6-fluoro-1-oxo-1,2-dihydroisoquinolin-7-yl)benzenesulfonamide

物理化学性质

• 分子式: C₁₆H₁₀FN₃O₃S
• 分子量: 343.3
• InChIKey: QCEOCULEQLXXFW-UHFFFAOYSA-N
• SMILES: C1=CC(=CC=C1C#N)S(=O)(=O)NC2=C(C=C3C=CNC(=O)C3=C2)F

靶点实验

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实验名称：Inhibition of human full length N-terminal His-tagged AICARFT expressed in Escherichi... 来源：ChEMBL 靶标：Bifunctional purine biosynthesis protein ATIC External Id：CHEMBL4022773

实验名称：Clearance in CD-1 mouse at 1 mg/kg, iv by LC-MS/MS method 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL4022782

实验名称：Oral bioavailability in CD-1 mouse at 10 mg/kg by LC-MS/MS method 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL4022783

实验名称：Permeability across apical to basolateral side in MDCK cells at 20 uM 来源：ChEMBL 靶标：N/A External Id：CHEMBL4022780

实验名称：AUC in CD-1 mouse at 10 mg/kg, po by LC-MS/MS method 来源：ChEMBL 靶标：Mus musculus External Id：CHEMBL4022781

实验名称：Equilibrium aqueous solubility of the compound at pH 6 after 20 hrs by HPLC method 来源：ChEMBL 靶标：N/A External Id：CHEMBL4022778

实验名称：Equilibrium aqueous solubility of the compound at pH 7.5 after 20 hrs by HPLC method 来源：ChEMBL 靶标：N/A External Id：CHEMBL4022779

实验名称：Lipophilicity, log D of the compound at pH 7 来源：ChEMBL 靶标：N/A External Id：CHEMBL4022776

实验名称：Equilibrium aqueous solubility of the compound at pH 2 after 20 hrs by HPLC method 来源：ChEMBL 靶标：N/A External Id：CHEMBL4022777

实验名称：Inhibition of AICARFT in human NCI-H460 cells assessed as increase in ZMP levels usin... 来源：ChEMBL 靶标：Bifunctional purine biosynthesis protein ATIC External Id：CHEMBL4022774

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