2'-(((4-((Benzamido)sulfonyl)phenyl)amino)carbonyl)-(1,1'-biphenyl)-2-carboxylic acid
Basic information
- CAS
160986-43-6- Standard SMILES
O=C(NS(=O)(=O)c1ccc(NC(=O)c2ccccc2-c2ccccc2C(=O)O)cc1)c1ccccc1- InChIKey
YJVZZPMHMCRGJL-UHFFFAOYSA-N- Molecular formula
- C27H20N2O6S
- Average molar mass
- 500.5 g/mol
- Monoisotopic mass
- 500.10420754
Names & identifiers
- Preferred name
- 2'-(((4-((Benzamido)sulfonyl)phenyl)amino)carbonyl)-(1,1'-biphenyl)-2-carboxylic acid
- IUPAC
- 2-[2-[[4-(benzoylsulfamoyl)phenyl]carbamoyl]phenyl]benzoic acid
Names & synonyms
160986-43-62'-(((4-((Benzamido)sulfonyl)phenyl)amino)carbonyl)-(1,1'-biphenyl)-2-carboxylic acid2'-[[[4-[(Benzamido)sulfonyl]phenyl]amino]carbonyl]-[1,1'-biphenyl]-2-carboxylic acidDTXSID801670492-[2-[[4-(benzoylsulfamoyl)phenyl]carbamoyl]phenyl]benzoic acid2'-{[4-(Benzoylsulfamoyl)phenyl]carbamoyl}[1,1'-biphenyl]-2-carboxylic acid
Database identifiers
- CAS
160986-43-6- PubChem CID
- 460400
- DTXSID
DTXSID80167049- Nikkaji
- J651.597E
Properties
Computed structural properties
- XLogP
- 4.3
- Topological polar surface area
- 138 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 886
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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