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Grapiprant

CAT: 1410-M14424-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M14424-01Size:5 mg
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Description
A novel EP4 antagonist; an analgesic and anti-inflammatory drug in the piprant class that was approved for Veterinary Medicine for the control of pain and inflammation.
CAS Number
415903-37-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
491.6052
Molecular Formula
C26H29N5O3S
Notes
Research use only, not for human use.
Receptor
Prostaglandin Receptor

Chemical Information

Grapiprant

Grapiprant, also known as AT-001 and CJ-023, is a drug from the piprant class. These molecules were derived from acylsulfonamide and are characterized to be a novel series of para-N-acylaminomethylbenzoic acid known to be prostaglandin receptor antagonists. This type of molecules is currently in development for veterinary patients. This class of drugs was defined in 2013 by the World Health Organization. Grapiprant has been approved in March 2016 by the FDA's Center for Veterinary Medicine as a non-cyclooxygenase inhibiting NSAID for veterinary use.

CAS Number415903-37-6
PubChem CID11677589
IUPAC Name1-[2-[4-(2-ethyl-4,6-dimethylimidazo[4,5-c]pyridin-1-yl)phenyl]ethyl]-3-(4-methylphenyl)sulfonylurea
Molecular FormulaC26H29N5O3S
Molecular Weight491.6
XLogP4.6
Topological Polar Surface Area114
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count35
Formal Charge0
Complexity802
SMILES
CCC1=NC2=C(N1C3=CC=C(C=C3)CCNC(=O)NS(=O)(=O)C4=CC=C(C=C4)C)C=C(N=C2C)C
InChI
InChI=1S/C26H29N5O3S/c1-5-24-29-25-19(4)28-18(3)16-23(25)31(24)21-10-8-20(9-11-21)14-15-27-26(32)30-35(33,34)22-12-6-17(2)7-13-22/h6-13,16H,5,14-15H2,1-4H3,(H2,27,30,32)
InChIKey
HZVLFTCYCLXTGV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Grapiprant
CAS: 415903-37-6
CID: 11677589
Formula: C26H29N5O3S
MW: 491.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight491.6
XLogP34.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass491.19911098
Monoisotopic Mass491.19911098
Topological Polar Surface Area114 Ų
Heavy Atom Count35
Formal Charge0
Complexity802
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
GTR19164466-01Grapiprant
HY-16781R-01Grapiprant (Standard)
CS-O-48489Grapiprant D5
RM-G180102-01Grapiprant Impurity 2
RM-G180103-01Grapiprant Impurity 3
RM-G180104-01Grapiprant Impurity 4
MBS3841287-01Grapiprant (CJ-023423)
RM-G180101-01Grapiprant Impurity 1
A15964-100Grapiprant (CJ-023423) 100mg
C12131-01Grapiprant (CJ-023,423)

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