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Amfenac

CAT: 1299-RM-A130600-03Size: 50 mgDry Ice: NoHazardous: No
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CAT#:1299-RM-A130600-03Size:50 mg
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CAS Number
51579-82-9
Synonyms
2- (2-amino-3-benzoylphenyl) acetic acid
Molecular Formula
C15H13NO3
Molecular Weight
255.27
Target Alternative Name
Amfenac
Product Name Synonym
2- (2-amino-3-benzoylphenyl) acetic acid

Chemical Information

Amfenac

Amfenac is an oxo monocarboxylic acid that is benzophenone in which one of the phenyl groups is substituted by an amino group and a carboxymethyl group at position 2 and 3, respectively. The corresponding carboxamide, nepafenac, is a prodrug of amfenac and is used for the treatment of pain and inflammation following cataract surgery. It has a role as a non-steroidal anti-inflammatory drug, a non-narcotic analgesic, an antipyretic, a cyclooxygenase 2 inhibitor and a cyclooxygenase 1 inhibitor. It is a member of benzophenones, an amino acid, an oxo monocarboxylic acid, a substituted aniline and a primary amino compound. It is a conjugate acid of an amfenac(1-).

CAS Number51579-82-9
PubChem CID2136
IUPAC Name2-(2-amino-3-benzoylphenyl)acetic acid
Molecular FormulaC15H13NO3
Molecular Weight255.27
XLogP2.6
Topological Polar Surface Area80.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count19
Formal Charge0
Complexity336
SMILES
C1=CC=C(C=C1)C(=O)C2=CC=CC(=C2N)CC(=O)O
InChI
InChI=1S/C15H13NO3/c16-14-11(9-13(17)18)7-4-8-12(14)15(19)10-5-2-1-3-6-10/h1-8H,9,16H2,(H,17,18)
InChIKey
SOYCMDCMZDHQFP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Amfenac
CAS: 51579-82-9
CID: 2136
Formula: C15H13NO3
MW: 255.27
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight255.27
XLogP32.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass255.08954328
Monoisotopic Mass255.08954328
Topological Polar Surface Area80.4 Ų
Heavy Atom Count19
Formal Charge0
Complexity336
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
T1720L-01Amfenac
AR-A01885-01Amfenac Lactam (Amfenac Impurity D)
T20197-01Amfenac sodium
AR-A01883-01Amfenac-d5
HY-17479B-01Amfenac (sodium)
AR-A01884-01Amfenac Glucuronide
CS-T-64770Amfenac Methyl Ester
CS-T-64686Amfenac Ethyl Ester
HY-17479A-01Amfenac (Sodium Hydrate)
MBS3841639-01Amfenac Sodium Monohydrate

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