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Vamagloxistat

CAT: 0804-HY-156648Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-156648Size:1 Each
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Description
Vamagloxistat is glycolate oxidase inhibitor, used to inhibit hyperoxaluria and kidney stones[1].
CAS Number
2408241-62-1
UNSPSC
12352005
Target
Others
Type
Reference compound
Related Pathways
Others
Applications
Metabolism-protein/nucleotide metabolism
Field of Research
Metabolic Disease
Assay Protocol
https://www.medchemexpress.com/vamagloxistat.html
Solubility
10 mM in DMSO
Smiles
O=C(C1=C(OC2=CC=C(C3=CC=C(C4CC(F)(C4)F)C=C3)C=C2)NN=N1)O
Molecular Formula
C19H15F2N3O3
Molecular Weight
371.34
References & Citations
[1]Maag, et al. Preparation of triazole carboxylic acids and esters as glycolate oxidase inhibitors for the treatment of diseases. World Intellectual Property Organization, WO2020010309 A1. 2020-01-09.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Vamagloxistat

Vamagloxistat is a small molecule drug. Vamagloxistat has a monoisotopic molecular weight of 371.11 Da.

CAS Number2408241-62-1
PubChem CID147368503
IUPAC Name4-[4-[4-(3,3-difluorocyclobutyl)phenyl]phenoxy]-1H-triazole-5-carboxylic acid
Molecular FormulaC19H15F2N3O3
Molecular Weight371.3
XLogP4.2
Topological Polar Surface Area88.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity526
SMILES
C1C(CC1(F)F)C2=CC=C(C=C2)C3=CC=C(C=C3)OC4=C(NN=N4)C(=O)O
InChI
InChI=1S/C19H15F2N3O3/c20-19(21)9-14(10-19)13-3-1-11(2-4-13)12-5-7-15(8-6-12)27-17-16(18(25)26)22-24-23-17/h1-8,14H,9-10H2,(H,25,26)(H,22,23,24)
InChIKey
DIQJDWGODFNEHC-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Vamagloxistat
CAS: 2408241-62-1
CID: 147368503
Formula: C19H15F2N3O3
MW: 371.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight371.3
XLogP34.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass371.10814767
Monoisotopic Mass371.10814767
Topological Polar Surface Area88.1 Ų
Heavy Atom Count27
Formal Charge0
Complexity526
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
GTR19219052-01Vamagloxistat
T203124-01Vamagloxistat sodium

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