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COQ7-IN-1

CAT: 0804-HY-133033-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-133033-01Size:5 mg
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Description
COQ7-IN-1, a highly potent inhibitor of human coenzyme Q (COQ7), interferes with ubiquinone (UQ) synthesis. COQ7-IN-1 does not disturb physiological cell growth of human normal culture cells. COQ7-IN-1 can be used for the research of the balance between UQ supplementation pathways: de novo UQ synthesis and extracellular UQ uptake[1].
CAS Number
2579696-72-1
UNSPSC
12352005
Target
Mitochondrial Metabolism
Type
Reference compound
Related Pathways
Metabolic Enzyme/Protease
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/coq7-in-1.html
Purity
99.98
Solubility
DMSO : 100 mg/mL (ultrasonic)
Smiles
OC1=CC(C2=CC=CC=C2)=NN1C3=CC=C(Cl)C=N3
Molecular Formula
C14H10ClN3O
Molecular Weight
271.70
References & Citations
[1]Keiko Tsuganezawa, et al. Identification of small molecule inhibitors of human COQ7. Bioorg Med Chem. 2020 Jan 1;28 (1) :115182.
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Coq7-IN-1
CAS Number2579696-72-1
PubChem CID155981996
IUPAC Name2-(5-chloro-2-pyridinyl)-5-phenyl-1H-pyrazol-3-one
Molecular FormulaC14H10ClN3O
Molecular Weight271.70
XLogP3
Topological Polar Surface Area45.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count19
Formal Charge0
Complexity379
SMILES
C1=CC=C(C=C1)C2=CC(=O)N(N2)C3=NC=C(C=C3)Cl
InChI
InChI=1S/C14H10ClN3O/c15-11-6-7-13(16-9-11)18-14(19)8-12(17-18)10-4-2-1-3-5-10/h1-9,17H
InChIKey
IRQULQWSSURBFT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Coq7-IN-1
CAS: 2579696-72-1
CID: 155981996
Formula: C14H10ClN3O
MW: 271.70
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight271.70
XLogP33
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass271.0512396
Monoisotopic Mass271.0512396
Topological Polar Surface Area45.2 Ų
Heavy Atom Count19
Formal Charge0
Complexity379
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