Celecoxib Carboxylic Acid
HIT212023587
sdf文件结构编辑类似物检索
HIT ID: HIT212023587
Cas No: 170571-01-4
分子式: C17H12F3N3O4S
分子量: 411.36
常用名: Celecoxib Carboxylic Acid
氢键受体数 (HBA): 5
氢键供体数 (HBD): 2
LogP: 3.1536033
IUPAC: 4-[1-(4-sulfamoylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzoic acid
IUPAC: 4-[1-(4-sulfamoylphenyl)-3-(trifluoromethyl)-1H-pyrazol-5-yl]benzoic acid
SMILES: NS(=O)(=O)c1ccc(cc1)-n1nc(cc1-c1ccc(cc1)C(O)=O)C(F)(F)F
SMILES: NS(=O)(=O)c1ccc(cc1)-n1nc(cc1-c1ccc(cc1)C(O)=O)C(F)(F)F
InChI key: WTHNOVFEXONZMI-UHFFFAOYSA-N
共显示3个结果
供应商规格单价货期纯度操作
TargetMol
SC
待询35日内发货点击询价
BIONET-Key Organics
BB
-3-5周点击询价
Mcule
SC
15164-5周 购物车
TargetMol | Target Loading
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