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1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide

更新时间:2025-08-26 10:07:09

1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide结构式
1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide结构式
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常用名 1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide 英文名 1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide
CAS号 509076-59-9 分子量 334.33700
密度 N/A 沸点 N/A
分子式 C12H9F3N2O2S2 熔点 N/A
MSDS N/A 闪点 N/A

 名称

英文名 1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide

 物理化学性质

分子式 C12H9F3N2O2S2
分子量 334.33700
精确质量 334.00600
PSA 95.97000
LogP 3.99700
InChIKey ALOKHRRVYXMQQV-UHFFFAOYSA-N
SMILES O=S(=O)(Nc1ccncc1Sc1ccccc1)C(F)(F)F

 合成线路

~%

1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide结构式

1,1,1-trifluoro...

509076-59-9

文献:Julemont, Fabien; De Leval, Xavier; Michaux, Catherine; Renard, Jean-Francois; Winum, Jean-Yves; Montero, Jean-Louis; Damas, Jacques; Dogne, Jean-Michel; Pirotte, Bernard Journal of Medicinal Chemistry, 2004 , vol. 47, # 27 p. 6749 - 6759

~%

1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide结构式

1,1,1-trifluoro...

509076-59-9

文献:Julemont, Fabien; De Leval, Xavier; Michaux, Catherine; Renard, Jean-Francois; Winum, Jean-Yves; Montero, Jean-Louis; Damas, Jacques; Dogne, Jean-Michel; Pirotte, Bernard Journal of Medicinal Chemistry, 2004 , vol. 47, # 27 p. 6749 - 6759

~%

1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide结构式

1,1,1-trifluoro...

509076-59-9

文献:Julemont, Fabien; De Leval, Xavier; Michaux, Catherine; Renard, Jean-Francois; Winum, Jean-Yves; Montero, Jean-Louis; Damas, Jacques; Dogne, Jean-Michel; Pirotte, Bernard Journal of Medicinal Chemistry, 2004 , vol. 47, # 27 p. 6749 - 6759

~%

1,1,1-trifluoro-N-(3-phenylsulfanylpyridin-4-yl)methanesulfonamide结构式

1,1,1-trifluoro...

509076-59-9

文献:Julemont, Fabien; De Leval, Xavier; Michaux, Catherine; Renard, Jean-Francois; Winum, Jean-Yves; Montero, Jean-Louis; Damas, Jacques; Dogne, Jean-Michel; Pirotte, Bernard Journal of Medicinal Chemistry, 2004 , vol. 47, # 27 p. 6749 - 6759

 靶点实验

查看更多实验

实验名称:Dissociation constant, pKa by sulfonamide/sulfonamidate equilibrium
来源:ChEMBL
靶标:N/A
External Id:CHEMBL916308
实验名称:Dissociation constant, pKa by pyridinium/pyridine equilibrium
来源:ChEMBL
靶标:N/A
External Id:CHEMBL916309
实验名称:Inhibition of COX2 in human whole blood assessed as inhibition of LPS-stimulated PGE2...
来源:ChEMBL
靶标:Prostaglandin G/H synthase 2
External Id:CHEMBL916302
实验名称:Selectivity ratio of IC50 for human COX1 to IC50 for human COX2
来源:ChEMBL
靶标:N/A
External Id:CHEMBL916303
实验名称:Inhibition of COX1 in human whole blood assessed as inhibition of calcium ionophore A...
来源:ChEMBL
靶标:Prostaglandin G/H synthase 1
External Id:CHEMBL916301
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