5-Amino-2-((4-aminophenyl)sulfonyl)benzenesulfonamide
Basic information
- CAS
17615-73-5- Standard SMILES
Nc1ccc(S(=O)(=O)c2ccc(N)cc2S(N)(=O)=O)cc1- InChIKey
JDZPLYBLBIKFHJ-UHFFFAOYSA-N- Molecular formula
- C12H13N3O4S2
- Average molar mass
- 327.4 g/mol
- Monoisotopic mass
- 327.03474825
Overview
Sulfamoyldapsone is a member of benzenes and a sulfonamide.
Names & identifiers
- Preferred name
- 5-Amino-2-((4-aminophenyl)sulfonyl)benzenesulfonamide
- IUPAC
- 5-amino-2-(4-aminophenyl)sulfonylbenzenesulfonamide
- English name
- SDDS
- Molecular formula
- C12H13N3O4S2
- Molecular weight
- 327.38
Names & synonyms
Sulfamoyldapsone17615-73-5SDDSMetanilamide, 6-sulfanilyl-LXU2HPW98X5-amino-2-[(4-aminophenyl)sulfonyl]benzenesulfonamide2-sulfamoyl-4,4'-diaminodiphenyl sulfone5-Amino-2-((4-aminophenyl)sulfonyl)benzenesulfonamideBenzenesulfonamide, 5-amino-2-((4-aminophenyl)sulfonyl)-Benzenesulfonamide, 5-amino-2-[(4-aminophenyl)sulfonyl]-RefChem:9132395-amino-2-(4-aminophenyl)sulfonylbenzenesulfonamide
Show more names
Sulfamoyldapsone Standard3-Amino-6-sulfanilylbenzenesulfonamide
6-(p-Anilinosulfonyl)metanilamide6-Sulfanilylmetanilamide2-Sulfamonyl-4,4'-diaminophenylsulfoneBRN 34358802-Sulfamonyl-4,4'-diaminodiphenyl-sulfone3-14-00-02271 (Beilstein Handbook Reference)SCHEMBL29388003CHEBI:81723
Database identifiers
- CAS
17615-73-5- PubChem CID
- 87190
- DTXSID
DTXSID90170089- ChEBI
CHEBI:81723
Properties
Computed structural properties
- XLogP
- -0.9
- Topological polar surface area
- 163 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 556
Physicochemical properties
- Melting point
- 238 °C · 238 °C
- Boiling point
- 686.1 · 686.1±65.0 °C(Predicted)
- Density
- 1.4541 · 1.4541 (rough estimate)
- refractive index
- 1.639 · 1.6390 (estimate)
- pka
- 9.72 · 9.72±0.60(Predicted)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 2 HPW98X · LXU2HPW98X
- Toxicity
- 50 ipr-mus: · LD50 ipr-mus: 5150 mg/kg OYYAA2 2,184,68
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 ipr-mus: 5150 mg/kg OYYAA2 2,184,68
Chemistry & industry
Additional notes
DefinitionChEBI: Sulfamoyldapsone is a member of benzenes and a sulfonamide.
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Compound notes
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