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Flurbiprofen Sodium

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Also known as: 56767-76-1, Sodium flurbiprofen, Ocufen, Sodium;2-(3-fluoro-4-phenylphenyl)propanoate, Flurbiprofen sodium?, M3qe6as001

Molecular Formula

C₁₅H₁₂FNaO₂

Molecular Weight

266.24 g/mol

InChI Key

AUAGTGKMTMVIKN-UHFFFAOYSA-M

FDA UNII

M3QE6AS001

An anti-inflammatory analgesic and antipyretic of the phenylalkynoic acid series. It has been shown to reduce bone resorption in periodontal disease by inhibiting CARBONIC ANHYDRASE.

1 2D Structure

Flurbiprofen Sodium

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

sodium;2-(3-fluoro-4-phenylphenyl)propanoate

2.1.2 InChI

InChI=1S/C15H13FO2.Na/c1-10(15(17)18)12-7-8-13(14(16)9-12)11-5-3-2-4-6-11;/h2-10H,1H3,(H,17,18);/q;+1/p-1

2.1.3 InChI Key

AUAGTGKMTMVIKN-UHFFFAOYSA-M

2.1.4 Canonical SMILES

CC(C1=CC(=C(C=C1)C2=CC=CC=C2)F)C(=O)[O-].[Na+]

2.2 Other Identifiers

2.2.1 UNII

M3QE6AS001

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 2-fluoro-alpha-methyl-(1,1'-biphenyl)-4-acetic Acid

2. Ansaid

3. Apo Flurbiprofen

4. Apo-flurbiprofen

5. Bts 18322

6. Bts-18322

7. Bts18322

8. Cebutid

9. Dobrofen

10. E 7869

11. E-7869

12. E7869

13. Flubiprofen

14. Flugalin

15. Flurbiprofen

16. Fluriproben

17. Froben

18. Froben Sr

19. Neo Artrol

20. Novo Flurprofen

21. Novo-flurprofen

22. Nu Flurbiprofen

23. Nu-flurbiprofen

24. Ocufen

25. Ocuflur

26. Ratio Flurbiprofen

27. Ratio-flurbiprofen

28. Strefen

2.3.2 Depositor-Supplied Synonyms

1. 56767-76-1

2. Sodium Flurbiprofen

3. Ocufen

4. Sodium;2-(3-fluoro-4-phenylphenyl)propanoate

5. Flurbiprofen Sodium?

6. M3qe6as001

7. Flurbiprofen Sodium [usp]

8. Flurbiprofen Sodium Salt

9. Flurbiprofen Sodium Anhydrous

10. Einecs 260-373-2

11. Sodium 3-fluoro-4-phenylhydratropate

12. Unii-m3qe6as001

13. 2-fluoro-alpha-methyl-4-diphenylacetic Acid Sodium Salt

14. Sodium 2-fluoro-alpha-methyl-(1,1'-biphenyl)-4-acetate

15. Sodium 2-(2-fluorobiphenyl-4-yl)propanoate

16. Schembl4735171

17. Chembl1200990

18. Dtxsid80972216

19. (1,1'-biphenyl)-4-acetic Acid, 2-fluoro-alpha-methyl-, Sodium Salt

20. Flurbiprofen Sodium [who-dd]

21. Db-072190

22. (+/-)-flurbiprofen Sodium Anhydrous

23. Flurbiprofen Sodium Anhydrous, (+/-)-

24. Q27283443

25. Sodium2-(2-fluoro-[1,1'-biphenyl]-4-yl)propanoate

26. 2-(2-fluorobiphenyl-4-yl)propionic Acid Sodium Salt

27. 2-fluoro-.alpha.-methyl-4-diphenylacetic Acid Sodium Salt

28. (1,1'-biphenyl)-4-acetic Acid, 2-fluoro-.alpha.-methyl-, Sodium Salt (1:1)

2.4 Create Date

2008-02-05

3 Chemical and Physical Properties

Molecular Formula	C₁₅H₁₂FNaO₂
Molecular Weight	266.24 g/mol
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	3
Exact Mass	266.07190207 g/mol
Monoisotopic Mass	266.07190207 g/mol
Topological Polar Surface Area	40.1 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	292
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	2

4 Drug and Medication Information

4.1 Drug Information

1 of 4
Drug Name	Flurbiprofen sodium
Drug Label	OCUFEN (flurbiprofen sodium ophthalmic solution, USP) 0.03% is a sterile topical nonsteroidal anti-inflammatory product for ophthalmic use. Chemical Name:Sodium ()-2-(2-fluoro-4-biphenylyl) propionate dihydrate. Structural Formula:C15H12FNaO22...
Active Ingredient	Flurbiprofen sodium
Dosage Form	Solution/drops
Route	Ophthalmic
Strength	0.03%
Market Status	Prescription
Company	Bausch And Lomb

2 of 4
Drug Name	Ocufen
PubMed Health	Flurbiprofen
Drug Classes	Analgesic, Antirheumatic, Central Nervous System Agent, Musculoskeletal Agent, NSAID, Ophthalmologic Agent, Propionic Acid
Drug Label	OCUFEN (flurbiprofen sodium ophthalmic solution, USP) 0.03% is a sterile topical nonsteroidal anti-inflammatory product for ophthalmic use. Chemical Name:Sodium ()-2-(2-fluoro-4-biphenylyl) propionate dihydrate. Structural Formula:C15H12FNaO22...
Active Ingredient	Flurbiprofen sodium
Dosage Form	Solution/drops
Route	Ophthalmic
Strength	0.03%
Market Status	Prescription
Company	Allergan

3 of 4
Drug Name	Flurbiprofen sodium
Drug Label	OCUFEN (flurbiprofen sodium ophthalmic solution, USP) 0.03% is a sterile topical nonsteroidal anti-inflammatory product for ophthalmic use. Chemical Name:Sodium ()-2-(2-fluoro-4-biphenylyl) propionate dihydrate. Structural Formula:C15H12FNaO22...
Active Ingredient	Flurbiprofen sodium
Dosage Form	Solution/drops
Route	Ophthalmic
Strength	0.03%
Market Status	Prescription
Company	Bausch And Lomb

4 of 4
Drug Name	Ocufen
PubMed Health	Flurbiprofen
Drug Classes	Analgesic, Antirheumatic, Central Nervous System Agent, Musculoskeletal Agent, NSAID, Ophthalmologic Agent, Propionic Acid
Drug Label	OCUFEN (flurbiprofen sodium ophthalmic solution, USP) 0.03% is a sterile topical nonsteroidal anti-inflammatory product for ophthalmic use. Chemical Name:Sodium ()-2-(2-fluoro-4-biphenylyl) propionate dihydrate. Structural Formula:C15H12FNaO22...
Active Ingredient	Flurbiprofen sodium
Dosage Form	Solution/drops
Route	Ophthalmic
Strength	0.03%
Market Status	Prescription
Company	Allergan

5 Pharmacology and Biochemistry

5.1 MeSH Pharmacological Classification

Analgesics

Compounds capable of relieving pain without the loss of CONSCIOUSNESS. (See all compounds classified as Analgesics.)

Anti-Inflammatory Agents, Non-Steroidal

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects. (See all compounds classified as Anti-Inflammatory Agents, Non-Steroidal.)

Cyclooxygenase Inhibitors

Compounds or agents that combine with cyclooxygenase (PROSTAGLANDIN-ENDOPEROXIDE SYNTHASES) and thereby prevent its substrate-enzyme combination with arachidonic acid and the formation of eicosanoids, prostaglandins, and thromboxanes. (See all compounds classified as Cyclooxygenase Inhibitors.)

5.2 FDA Pharmacological Classification

5.2.1 Pharmacological Classes

Cyclooxygenase Inhibitors [MoA]; Nonsteroidal Anti-inflammatory Drug [EPC]; Anti-Inflammatory Agents, Non-Steroidal [CS]