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1-(2,5-二氯-4-磺酰基苯基)-3-甲基-5-吡唑酮

更新时间:2025-09-25 10:23:52

1-(2,5-二氯-4-磺酰基苯基)-3-甲基-5-吡唑酮结构式
1-(2,5-二氯-4-磺酰基苯基)-3-甲基-5-吡唑酮结构式
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常用名 1-(2,5-二氯-4-磺酰基苯基)-3-甲基-5-吡唑酮 英文名 1-(2,5-dichloro-4-sulfo-phenyl)-5-oxo-4H-pyrazole-3-carboxylic acid
CAS号 7253-04-5 分子量 353.13500
密度 1.95g/cm3 沸点 N/A
分子式 C10H6Cl2N2O6S 熔点 N/A
MSDS N/A 闪点 N/A

 名称

中文名 1-(2,5-二氯-4-磺酰基苯基)-3-甲基-5-吡唑酮
英文名 1-(2:5-Dichloro-4-Sulphophenyl) -3- Methyl -5- Pyrazolone

 物理化学性质

密度 1.95g/cm3
分子式 C10H6Cl2N2O6S
分子量 353.13500
精确质量 351.93200
PSA 132.72000
LogP 1.99880
InChIKey YVFMPXVMGPZCRS-UHFFFAOYSA-N
SMILES O=C(O)C1=NN(c2cc(Cl)c(S(=O)(=O)O)cc2Cl)C(=O)C1
折射率 1.743

 靶点实验

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External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
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External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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来源:ChEMBL
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External Id:CHEMBL4296186
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来源:Broad Institute
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External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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来源:Broad Institute
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External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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External Id:Sarm1 TIR NADase inhibitors
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External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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External Id:SIAE_INH_FP_1536_1X%INH PRUN
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来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:SBCCG-A1015-NR3A-Primary-Assay
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