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Pranoprofen

CAT: 0931-T0159-04Size: 1 gDry Ice: NoHazardous: No
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CAT#:0931-T0159-04Size:1 g
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
52549-17-4
Target
Apoptosis, Prostaglandin Receptor, COX, PGE Synthase
Related Pathways
Neuroscience, Apoptosis, GPCR/G Protein, Immunology/Inflammation
Purity
0.9988
Bioactivity
Pranoprofen (Pyranoprofen) (INN) is a non-steroidal anti-inflammatory drug used in ophthalmology.
Smiles
CC(C(O)=O)c1ccc2Oc3ncccc3Cc2c1
Molecular Formula
C15H13NO3
Molecular Weight
255.27
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Pranoprofen

Pranoprofen is a pyridochromene.

CAS Number52549-17-4
PubChem CID4888
IUPAC Name2-(5H-chromeno[2,3-b]pyridin-7-yl)propanoic acid
Molecular FormulaC15H13NO3
Molecular Weight255.27
XLogP2.7
Topological Polar Surface Area59.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity346
SMILES
CC(C1=CC2=C(C=C1)OC3=C(C2)C=CC=N3)C(=O)O
InChI
InChI=1S/C15H13NO3/c1-9(15(17)18)10-4-5-13-12(7-10)8-11-3-2-6-16-14(11)19-13/h2-7,9H,8H2,1H3,(H,17,18)
InChIKey
TVQZAMVBTVNYLA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Pranoprofen
CAS: 52549-17-4
CID: 4888
Formula: C15H13NO3
MW: 255.27
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight255.27
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass255.08954328
Monoisotopic Mass255.08954328
Topological Polar Surface Area59.4 Ų
Heavy Atom Count19
Formal Charge0
Complexity346
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