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ERRγ agonist-2

CAT: 0013-GTR19220872-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19220872-01Size:5 mg
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Description
ERRγ agonist-2 is a potent and selective inverse agonist of ERRγ (Kd = 6.5 μM) . It suppresses hepcidin, fibrinogen, and gluconeogenic gene expression, leading to observed antimicrobial, anticoagulant, and antidiabetic activities in research models, making it a useful tool for studying metabolic and inflammatory pathways.
CAS Number
324022-01-7
Field of Research
Metabolism Research, Pharmacology & Drug Discovery
Smiles
C (NC1=CC (OC=2C=CC=NC2) =CC (N) =C1) (=O) C=3C (=NN (C3) C4=CC=CC=C4) C5=CC=CC=C5
Molecular Formula
C27H21N5O2
Molecular Weight
447.49
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

ERRgamma inverse agonist 2
CAS Number324022-01-7
PubChem CID1034987
IUPAC NameN-(3-amino-5-pyridin-3-yloxyphenyl)-1,3-diphenylpyrazole-4-carboxamide
Molecular FormulaC27H21N5O2
Molecular Weight447.5
XLogP4.2
Topological Polar Surface Area95.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Heavy Atom Count34
Formal Charge0
Complexity651
SMILES
C1=CC=C(C=C1)C2=NN(C=C2C(=O)NC3=CC(=CC(=C3)N)OC4=CN=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C27H21N5O2/c28-20-14-21(16-24(15-20)34-23-12-7-13-29-17-23)30-27(33)25-18-32(22-10-5-2-6-11-22)31-26(25)19-8-3-1-4-9-19/h1-18H,28H2,(H,30,33)
InChIKey
ODZPKVAISZKCGI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of ERRgamma inverse agonist 2
CAS: 324022-01-7
CID: 1034987
Formula: C27H21N5O2
MW: 447.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight447.5
XLogP34.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count6
Exact Mass447.16952493
Monoisotopic Mass447.16952493
Topological Polar Surface Area95.1 Ų
Heavy Atom Count34
Formal Charge0
Complexity651
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

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Alternative Products

CatalogName
T74840-01ERRγ agonist-2
HY-149833ERRγ inverse agonist 2
T60772-01ERRγ agonist-1
T11231-01ERRγ Inverse Agonist 1
TBI3948-50MGSLU-PP-332, pan-ERR agonist/Exercise mimetic
HY-144699-01ERRα antagonist-2
HY-128839PROTAC ERRα Degrader-2
M20565-01PROTAC ERRα ligand 2
170466ESRRG (ERR3, ERR Gamma, ERR gamma-2, Err-gamma, NR3B3, ERRG2, ERRgamma, KIAA0832)
170467ESRRG (ERR3, ERR Gamma, ERR gamma-2, ERR3, Err-gamma, NR3B3, ERRG2, ERRgamma, KIAA0832)

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