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Gue1654

CAT: 1410-M34274-01Size: 1 EachDry Ice: NoHazardous: No
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Description
Gue1654 is a selective OXE-R inhibitor that attenuates coronary artery ligation-induced ischemic myocardial injury and cardiomyocyte oxygen/glucose deprivation-induced injury in mice through activation of BCAT1.Gue1654 inhibits OXE-R-inhibited protein kinase C-ε (PKC-ε) /nuclear factor κB (NF-κB) signaling and apoptosis in cardiomyocytes. Gue1654 can be used to study cardiovascular disease.
CAS Number
397290-30-1
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
447.6
Molecular Formula
C23H17N3OS3
Notes
Research use only, not for human use.
Receptor
NF-κB | PKC

Chemical Information

Gue1654

an oxoeicosanoid receptor 1 antagonist; structure in first source

CAS Number397290-30-1
PubChem CID5066134
IUPAC NameN-(2-methylsulfanyl-[1,3]thiazolo[4,5-g][1,3]benzothiazol-7-yl)-2,2-diphenylacetamide
Molecular FormulaC23H17N3OS3
Molecular Weight447.6
XLogP6.5
Topological Polar Surface Area137
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity578
SMILES
CSC1=NC2=C(S1)C3=C(C=C2)N=C(S3)NC(=O)C(C4=CC=CC=C4)C5=CC=CC=C5
InChI
InChI=1S/C23H17N3OS3/c1-28-23-25-17-13-12-16-19(20(17)30-23)29-22(24-16)26-21(27)18(14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2-13,18H,1H3,(H,24,26,27)
InChIKey
UFOBDFMYJABXGK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Gue1654
CAS: 397290-30-1
CID: 5066134
Formula: C23H17N3OS3
MW: 447.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight447.6
XLogP36.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass447.05337569
Monoisotopic Mass447.05337569
Topological Polar Surface Area137 Ų
Heavy Atom Count30
Formal Charge0
Complexity578
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
MBS5777212Gue1654
217609OXE-R-Gbg Coupling Modulator, Gue1654 (7- (Methylthio) -2- ((2,2-diphenylacetyl) amino) benzo[1,2-d:4,3-d’]bisthiazole, N- (7- (Methylsulfanyl) [1,3]thiazolo[4,5-g][1,3]benzothiazol-2-yl) -2,2-diphenylacetamide) discontinued

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