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2D Structure
Also known as: 80-03-5, Acediasulphone, N-p-sulfanilylphenylglycine, N-[4-[(4-aminophenyl)sulphonyl]phenyl]glycine, 30yp2yhh8w, Chembl48396
Molecular Formula
C14H14N2O4S
Molecular Weight
306.34  g/mol
InChI Key
FKKUMFTYSTZUJG-UHFFFAOYSA-N
FDA UNII
30YP2YHH8W

Acediasulfone is a long-acting prodrug of dapsone, used in the treatment of leprosy.
1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
2-[4-(4-aminophenyl)sulfonylanilino]acetic acid
2.1.2 InChI
InChI=1S/C14H14N2O4S/c15-10-1-5-12(6-2-10)21(19,20)13-7-3-11(4-8-13)16-9-14(17)18/h1-8,16H,9,15H2,(H,17,18)
2.1.3 InChI Key
FKKUMFTYSTZUJG-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC(=CC=C1N)S(=O)(=O)C2=CC=C(C=C2)NCC(=O)O
2.2 Other Identifiers
2.2.1 UNII
30YP2YHH8W
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Ace (sulfone)

2.3.2 Depositor-Supplied Synonyms

1. 80-03-5

2. Acediasulphone

3. N-p-sulfanilylphenylglycine

4. N-[4-[(4-aminophenyl)sulphonyl]phenyl]glycine

5. 30yp2yhh8w

6. Chembl48396

7. N-(4-((4-aminophenyl)sulphonyl)phenyl)glycine

8. 2-[4-(4-aminophenyl)sulfonylanilino]acetic Acid

9. Acediasulfonum

10. Nsc-158324

11. Unii-30yp2yhh8w

12. Einecs 201-243-7

13. Acediasulfone [mi]

14. Zinc862

15. Schembl143660

16. Acediasulfone [who-dd]

17. Dtxsid00229991

18. Chebi:135300

19. Bdbm50099670

20. Db08926

21. {4-[(4-aminophenyl)sulfonyl]anilino}acetic Acid

22. 2-(4-(4-aminophenylsulfonyl)phenylamino)acetic Acid

23. Q4673051

24. [4-(4-amino-benzenesulfonyl)-phenylamino]-acetic Acid

25. 2-({4-[(4-aminophenyl)sulfonyl]phenyl}amino)acetic Acid

2.4 Create Date
2005-03-26
3 Chemical and Physical Properties
Molecular Weight 306.34 g/mol
Molecular Formula C14H14N2O4S
XLogP31
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass306.06742811 g/mol
Monoisotopic Mass306.06742811 g/mol
Topological Polar Surface Area118 Ų
Heavy Atom Count21
Formal Charge0
Complexity444
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count1