(1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexanecarboxylic acid

Base Information

• Chemical Name: (1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexanecarboxylic acid
• CAS No.: 1212151-60-4
• Molecular Formula: C21H24N2O6S
• Molecular Weight: 432.5
• DSSTox Substance ID: DTXSID801113179

Synonyms:Oprea1_664520;Oprea1_742086;DTXSID801113179;STK060286;AKOS022083888;(1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexanecarboxylic acid;1212151-60-4;rel-(1R,2S)-2-[[[4-[[(4-Methoxyphenyl)amino]sulfonyl]phenyl]amino]carbonyl]cyclohexanecarboxylic acid

Chemical Property of (1R,2S)-2-({4-[(4-methoxyphenyl)sulfamoyl]phenyl}carbamoyl)cyclohexanecarboxylic acid

Chemical Property:

• XLogP3: 2.7
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 432.13550766
• Heavy Atom Count: 30
• Complexity: 691

Purity/Quality:

2-({4-[(4-Methoxyanilino)sulfonyl]anilino}carbonyl)cyclohexanecarboxylic acid ^*data from reagent suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)C3CCCCC3C(=O)O
• Isomeric SMILES: COC1=CC=C(C=C1)NS(=O)(=O)C2=CC=C(C=C2)NC(=O)[C@H]3CCCC[C@H]3C(=O)O

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