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Furprofen

CAT: 0931-T11340-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T11340-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
66318-17-0
Target
PGE Synthase, Prostaglandin Receptor
Related Pathways
GPCR/G Protein, Immunology/Inflammation
Purity
0.9932
Bioactivity
Furprofen is a non-steroidal anti-inflammatory agent that inhibits prostate (PGE) synthesis and is used in the study of rheumatoid arthritis and osteoarthritis.
Smiles
CC(C(O)=O)c1ccc(cc1)C(=O)c1ccco1
Molecular Formula
C14H12O4
Molecular Weight
244.24
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Furprofen

structure given in first source

CAS Number66318-17-0
PubChem CID162201
IUPAC Name2-[4-(furan-2-carbonyl)phenyl]propanoic acid
Molecular FormulaC14H12O4
Molecular Weight244.24
XLogP2.7
Topological Polar Surface Area67.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count18
Formal Charge0
Complexity318
SMILES
CC(C1=CC=C(C=C1)C(=O)C2=CC=CO2)C(=O)O
InChI
InChI=1S/C14H12O4/c1-9(14(16)17)10-4-6-11(7-5-10)13(15)12-3-2-8-18-12/h2-9H,1H3,(H,16,17)
InChIKey
ITJUVDBADHDNPU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Furprofen
CAS: 66318-17-0
CID: 162201
Formula: C14H12O4
MW: 244.24
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight244.24
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass244.07355886
Monoisotopic Mass244.07355886
Topological Polar Surface Area67.5 Ų
Heavy Atom Count18
Formal Charge0
Complexity318
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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