Molecular Identity
Bromfenac
2-[2-amino-3-(4-bromobenzoyl)phenyl]acetic acid
PubChem CID: 60726
Bromfenac is amfenac in which the the hydrogen at the 4 position of the benzoyl group is substituted by bromine. It is used for the management of ocular pain and treatment of postoperative inflammation in patients who have undergone cataract extraction. It was withdrawn from the US market in 1998, following concerns over off-label abuse and hepatic failure. It has a role as a non-steroidal anti-inflammatory drug and a non-narcotic analgesic. It is a member of benzophenones, an aromatic amino acid, an organobromine compound and a substituted aniline. It is functionally related to an amfenac. It is a conjugate acid of a bromfenac(1-).
2D Structure
Properties
C15H12BrNO3
Molecular Formula
334.16
Molecular Weight
g/mol
333.0001
Exact Mass
Da
3.3
XLogP
Drug-like (Lipinski: < 5)
80.4
TPSA
Good oral absorption (< 140 A²)
2
H-Bond Donors
4
H-Bond Acceptors
366
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Bromfenac91714-94-22-(2-Amino-3-(4-bromobenzoyl)phenyl)acetic acidBromfenaco2-[2-amino-3-(4-bromobenzoyl)phenyl]acetic acidBromfenacum2-Amino-3-(4-bromobenzoyl)benzeneacetic acidISV-303Benzeneacetic acid, 2-amino-3-(4-bromobenzoyl)-CHEBI:240107864P0921DW2-{2-amino-3-[(4-bromophenyl)carbonyl]phenyl}acetic acidDTXSID7040655[2-Amino-3-(4-bromo-benzoyl)-phenyl]-acetic acid(2-Amino-3-(4-bromo-benzoyl)-phenyl)-acetic acid
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to Bromfenac
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