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Epirizole

CAT: 0013-GTR19202556-02Size: 1 ml x 10 mM (in DMSO)Dry Ice: NoHazardous: No
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CAT#:0013-GTR19202556-02Size:1 ml x 10 mM (in DMSO)
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Description
Epirizole
CAS Number
18694-40-1
Product Name Alternative
Epirizole, Mebron, Mepirizole, Methopyrimazole, Dalex, DA398, DA-398, DA 398
Field of Research
Pharmacology & Drug Discovery
Purity
99.96% (May vary between batches)
Solubility
DMSO:27.5 mg/mL (117.4 mM)
Smiles
O (C) C=1N (C=2N=C (OC) C=C (C) N2) N=C (C) C1
Molecular Formula
C11H14N4O2
Molecular Weight
234.25
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Epirizole

Epirizole is an aromatic ether.

CAS Number18694-40-1
PubChem CID3242
IUPAC Name4-methoxy-2-(5-methoxy-3-methylpyrazol-1-yl)-6-methylpyrimidine
Molecular FormulaC11H14N4O2
Molecular Weight234.25
XLogP1.3
Topological Polar Surface Area62.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count17
Formal Charge0
Complexity254
SMILES
CC1=CC(=NC(=N1)N2C(=CC(=N2)C)OC)OC
InChI
InChI=1S/C11H14N4O2/c1-7-5-9(16-3)13-11(12-7)15-10(17-4)6-8(2)14-15/h5-6H,1-4H3
InChIKey
RHAXSHUQNIEUEY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Epirizole
CAS: 18694-40-1
CID: 3242
Formula: C11H14N4O2
MW: 234.25
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight234.25
XLogP31.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass234.11167570
Monoisotopic Mass234.11167570
Topological Polar Surface Area62.1 Ų
Heavy Atom Count17
Formal Charge0
Complexity254
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
M27114-01Epirizole
HY-103595R-01Epirizole (Standard)

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