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Chemistry

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Also known as: 7-bromo-5-methylquinolin-8-ol, 7175-09-9, 7-bromo-5-methyl-8-quinolinol, Tilbroquinol [inn], P6sb125nha, Tilbroquinol (inn)

Molecular Formula

C₁₀H₈BrNO

Molecular Weight

238.08 g/mol

InChI Key

JMOVFFLYGIQXMM-UHFFFAOYSA-N

FDA UNII

P6SB125NHA

Tilbroquinol was approved in France, Morocco, and Saudi Arabia but it has been withdrawn in France and Saudi Arabia markets mainly due to its hepatotoxicity risk outweighing the drug benefit. In Morocco, the drug has been limited to use in the treatment of intestinal amoebiasis.

1 2D Structure

Tilbroquinol

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

7-bromo-5-methylquinolin-8-ol

2.1.2 InChI

InChI=1S/C10H8BrNO/c1-6-5-8(11)10(13)9-7(6)3-2-4-12-9/h2-5,13H,1H3

2.1.3 InChI Key

JMOVFFLYGIQXMM-UHFFFAOYSA-N

2.1.4 Canonical SMILES

CC1=CC(=C(C2=C1C=CC=N2)O)Br

2.2 Other Identifiers

2.2.1 UNII

P6SB125NHA

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 7-bromo-5-methyl-8-quinolinol

2.3.2 Depositor-Supplied Synonyms

1. 7-bromo-5-methylquinolin-8-ol

2. 7175-09-9

3. 7-bromo-5-methyl-8-quinolinol

4. Tilbroquinol [inn]

5. P6sb125nha

6. Tilbroquinol (inn)

7. Tilbroquinolum

8. Tilbroquinolum [inn-latin]

9. Einecs 230-533-6

10. 5-methyl-7-bromo-8-hydroxyquinoline

11. Unii-p6sb125nha

12. Tilbroquinol [mart.]

13. Tilbroquinol [who-dd]

14. Schembl1441958

15. Zinc2170

16. Chembl1788385

17. Dtxsid80221973

18. Chebi:134965

19. Amy23445

20. 8-hydroxy-7-bromo-5-methylquinoline

21. Cs-1390

22. Db13222

23. Hy-15537

24. Db-074468

25. Ft-0757627

26. D07351

27. A917909

28. Q7802069

29. W-110201

2.4 Create Date

2005-08-08

3 Chemical and Physical Properties

Molecular Formula	C₁₀H₈BrNO
Molecular Weight	238.08 g/mol
XLogP3	3.1
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	236.97893 g/mol
Monoisotopic Mass	236.97893 g/mol
Topological Polar Surface Area	33.1 Å²
Heavy Atom Count	13
Formal Charge	0
Complexity	188
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

4 Pharmacology and Biochemistry

4.1 ATC Code

P - Antiparasitic products, insecticides and repellents

P01 - Antiprotozoals

P01A - Agents against amoebiasis and other protozoal diseases

P01AA - Hydroxyquinoline derivatives

P01AA05 - Tilbroquinol

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Tilbroquinol

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