N-[4-(5-Methyl-isoxazol-3-ylsulfamoyl)-phenyl]-phthalamic acid

Base Information

• Chemical Name: N-[4-(5-Methyl-isoxazol-3-ylsulfamoyl)-phenyl]-phthalamic acid
• CAS No.: 68274-44-2
• Molecular Formula: C18H15N3O6S
• Molecular Weight: 401.39300
• DSSTox Substance ID: DTXSID001133096
• Nikkaji Number: J1.977.913K
• Mol file: 68274-44-2.mol

Synonyms:Oprea1_161362;Oprea1_202177;DTXSID001133096;N-[4-(5-Methyl-isoxazol-3-ylsulfamoyl)-phenyl]-phthalamic acid;STK028465;AKOS000497201;68274-44-2;CS-0280753;EU-0047811;Z55165242;2-[4-(5-Methyl-3-isoxazolylsulfamoyl)phenylcarbamoyl]benzoic acid;2-((4-(n-(5-Methylisoxazol-3-yl)sulfamoyl)phenyl)carbamoyl)benzoic acid;2-({4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl}carbamoyl)benzoic acid;2-[(4-{[(5-Methyl-3-isoxazolyl)amino]sulfonyl}anilino)carbonyl]benzoic acid;2-[[[4-[[(5-Methyl-3-isoxazolyl)amino]sulfonyl]phenyl]amino]carbonyl]benzoic acid

Chemical Property of N-[4-(5-Methyl-isoxazol-3-ylsulfamoyl)-phenyl]-phthalamic acid

Chemical Property:

• PSA: 146.98000
• LogP: 3.96110
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 6
• Exact Mass: 401.06815638
• Heavy Atom Count: 28
• Complexity: 671

Purity/Quality:

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MSDS Files:

Useful:

• Canonical SMILES: CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3=CC=CC=C3C(=O)O

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