Basic information
- CAS
28842-70-8- Standard SMILES
O=[N+]([O-])c1ccc(S(=O)(=O)Nc2ccc(-c3ccccc3)cc2)cc1- InChIKey
INGUMVZZOPPYIJ-UHFFFAOYSA-N- Molecular formula
- C18H14N2O4S
- Average molar mass
- 354.4 g/mol
- Monoisotopic mass
- 354.06742811
Names & identifiers
- Preferred name
- 4-nitro-N-(4-phenylphenyl)benzenesulfonamide
- IUPAC
- 4-nitro-N-(4-phenylphenyl)benzenesulfonamide
Names & synonyms
4-nitro-N-(4-phenylphenyl)benzenesulfonamide28842-70-8MLS003106506N-[1,1'-biphenyl]-4-yl-4-nitrobenzenesulfonamideNSC159388CHEMBL1876389DTXSID10951478MFCD00377527AKOS001637186NSC-159388SMR001821407N-1,1'-biphenyl-4-yl-4-nitrobenzenesulfonamide
Show more names
AG-205/36507004SR-01000473807SR-01000473807-1N-([1,1'-Biphenyl]-4-yl)-4-nitrobenzene-1-sulfonamide
Database identifiers
- CAS
28842-70-8- PubChem CID
- 293085
- DTXSID
DTXSID10951478- ChEMBL
CHEMBL1876389
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 532
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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