4,4'-Azoxybis[N-(5-methyl-3-isoxazolyl)-benzenesulfonamide
Basic information
- CAS
119403-03-1- Standard SMILES
Cc1cc(NS(=O)(=O)c2ccc(N=[N+]([O-])c3ccc(S(=O)(=O)Nc4cc(C)on4)cc3)cc2)no1- InChIKey
AYMVIVQKFDDNLC-QLYXXIJNSA-N- Molecular formula
- C20H18N6O7S2
- Average molar mass
- 518.5 g/mol
- Monoisotopic mass
- 518.06783928
Names & identifiers
- Preferred name
- 4,4'-Azoxybis[N-(5-methyl-3-isoxazolyl)-benzenesulfonamide
- IUPAC
- [4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]imino-oxidoazanium
- English name
- 4,4'-Azoxybis[N-(5-Methyl-3-isoxazolyl)-benzenesulfonaMide
- Molecular formula
- C20H18N6O7S2
- Molecular weight
- 518.52
Names & synonyms
119403-03-14,4'-Azoxybis[N-(5-methyl-3-isoxazolyl)-benzenesulfonamideNSC665548NSC 665548[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]imino-oxidoazaniumAzoxysulfamethoxazole (1,2-bis(4-(5-methylisoxazol-3-yl-aminosulfonyl)phenyl)diazine-1-oxide)1,2-Bis(4-(N-(5-methylisoxazol-3-yl)sulfamoyl)phenyl)-2-oxohydrazin-2-ium-1-ideCHEMBL1998247NSC-665548Azoxysulfamethoxazole (1,2-bis[4-(5-methylisoxazol-3-yl- aminosulfonyl)phenyl]-diazine-1-oxide)NCI60_022623Benzenesulfonamide, 4,4'-azoxybis[N-(5-methyl-3-isoxazolyl)- (9CI)
Database identifiers
- CAS
119403-03-1- PubChem CID
- 380145
- ChEMBL
CHEMBL1998247
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 202 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 8
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 951
Physicochemical properties
- solubility
- Dimethyl Sulfoxide; THF
- form
- Solid
- color
- Yellow
Chemistry & industry
Applications
UsesBy-product in the preparation of sulfamethoxazole metabolite
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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