2,2-difluoro-6-[(4-methoxy-3-methylpyridin-2-yl)methylsulfinyl]-5H-[1,3]dioxolo[4,5-f]benzimidazole

• 常用名: 2,2-difluoro-6-[(4-methoxy-3-methylpyridin-2-yl)methylsulfinyl]-5H-[1,3]dioxolo[4,5-f]benzimidazole
• 英文名: 2,2-difluoro-6-[(4-methoxy-3-methylpyridin-2-yl)methylsulfinyl]-5H-[1,3]dioxolo[4,5-f]benzimidazole
• CAS号: 97966-86-4
• 分子量: 381.35400
• 密度: 1.63g/cm3
• 沸点: 581.1ºC at 760 mmHg
• 分子式: C₁₆H₁₃F₂N₃O₄S
• 熔点: N/A
• 闪点: 305.2ºC

名称

• 英文名: 2,2-difluoro-6-[(4-methoxy-3-methylpyridin-2-yl)methylsulfinyl]-5H-[1,3]dioxolo[4,5-f]benzimidazole

物理化学性质

• 密度: 1.63g/cm3
• 沸点: 581.1ºC at 760 mmHg
• 分子式: C₁₆H₁₃F₂N₃O₄S
• 分子量: 381.35400
• 闪点: 305.2ºC
• 精确质量: 381.05900
• PSA: 105.54000
• LogP: 3.76990
• InChIKey: HJUSJYIODNLSRR-UHFFFAOYSA-N
• SMILES: COc1ccnc(CS(=O)c2nc3cc4c(cc3[nH]2)OC(F)(F)O4)c1C
• 折射率: 1.691

靶点实验

查看更多实验

实验名称：In vitro evaluation for the inhibition of H+/K+ ATPase at pH < 3 in the gastric gland... 来源：ChEMBL 靶标：Potassium-transporting ATPase alpha chain 1 External Id：CHEMBL858329

实验名称：In vitro evaluation for its ability to inhibit the Na+/K+ ATPase at pH 7.4. 来源：ChEMBL 靶标：Sodium/potassium-transporting ATPase subunit beta-2 External Id：CHEMBL858332

实验名称：t1/2 (pH 3) 来源：ChEMBL 靶标：N/A External Id：CHEMBL635991

实验名称：pKa value (pyridine) 来源：ChEMBL 靶标：N/A External Id：CHEMBL634290

实验名称：t1/2 (pH 5) 来源：ChEMBL 靶标：N/A External Id：CHEMBL635992

实验名称：Half life at pH 7.4; Insoluble to measure 来源：ChEMBL 靶标：N/A External Id：CHEMBL637761

实验名称：pKa value (imidazole) 来源：ChEMBL 靶标：N/A External Id：CHEMBL639819

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英文别名

• 2,2-difluoro-6-{[(4-methoxy-3-methylpyridin-2-yl)methyl]sulfinyl}-5h-[1,3]dioxolo[4,5-f]benzimidazole
• 2,2-difluoro-6-[(4-methoxy-3-methyl-2-pyridyl)methylsulfinyl]-5H-[1,3]-dioxolo-[4,5-f]benzimidazole
• B 8301-078