Basic information
- CAS
133-65-3- Standard SMILES
O=S(=O)(c1ccc(NC(CC(c2ccccc2)S(=O)(=O)[O-])S(=O)(=O)[O-])cc1)c1ccc(NC(CC(c2ccccc2)S(=O)(=O)[O-])S(=O)(=O)[O-])cc1.[Na+].[Na+].[Na+].[Na+]- InChIKey
WAGUNVVOQBKLDL-UHFFFAOYSA-J- Molecular formula
- C30H28N2Na4O14S5
- Average molar mass
- 892.8 g/mol
- Monoisotopic mass
- 891.9734866
Overview
Solasulfone is a sulfonamide antibiotic used in the treatment of leprosy.
Names & identifiers
- Preferred name
- Solasulfone
- IUPAC
- tetrasodium;1-phenyl-3-[4-[4-[(3-phenyl-1,3-disulfonatopropyl)amino]phenyl]sulfonylanilino]propane-1,3-disulfonate
Names & synonyms
SOLASULFONESolapsoneSulfetroneSulphetroneSolasulphoneH12JE4313SDTXSID50927894soliusulfonsulusulfonePhenprofonCimedoneRefChem:184225
Show more names
DTXCID901356673RP36681,1'-(sulfonylbis(p-phenyleneimino))bis(3-phenyl-1,3-propanedisulfonic acid) tetrasodium salt205-116-7133-65-3Solasulfone [INN]Solasulfonatetrasodium;1-phenyl-3-[4-[4-[(3-phenyl-1,3-disulfonatopropyl)amino]phenyl]sulfonylanilino]propane-1,3-disulfonate
Database identifiers
- CAS
133-65-3- PubChem CID
- 8626
- DTXSID
DTXSID50927894- ChEMBL
CHEMBL2106031- UNII
- H12JE4313S
- EC Number
- 205-116-7
- Nikkaji
- J8.134E
Properties
Computed structural properties
- Topological polar surface area
- 329 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 16
- Rotatable bonds
- 12
- Heavy atoms
- 55
- Formal charge
- 0
- Complexity
- 1,490
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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