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XAP044

CAT: 0607-C3220-10Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0607-C3220-10Size:10 mg
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Description
mGluR7 antagonist
CAS Number
196928-50-4
Product Name Alternative
7-hydroxy-3-(4-iodophenoxy)-4H-1-benzopyran-4-one
Field of Research
GPCR G protein mGluR
Purity
0.98
Form
A crystalline solid
Solubility
≤10mg/ml in ethanol;20mg/ml in DMSO;20mg/ml in dimethyl formamide
Smiles
O=C1C2=CC=C(O)C=C2OC=C1OC3=CC=C(I)C=C3
Molecular Formula
C15H9IO4
Molecular Weight
380.1
Shipping Conditions
Blue ice
Storage Conditions
Store at -20°C.

Chemical Information

7-hydroxy-3-(4-iodophenoxy)-4H-chromen-4-one

Glutamate Receptor Antagonists

CAS Number196928-50-4
PubChem CID5428913
IUPAC Name7-hydroxy-3-(4-iodophenoxy)chromen-4-one
Molecular FormulaC15H9IO4
Molecular Weight380.13
XLogP3.6
Topological Polar Surface Area55.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity401
SMILES
C1=CC(=CC=C1OC2=COC3=C(C2=O)C=CC(=C3)O)I
InChI
InChI=1S/C15H9IO4/c16-9-1-4-11(5-2-9)20-14-8-19-13-7-10(17)3-6-12(13)15(14)18/h1-8,17H
InChIKey
XXZKJJYWINSUMJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 7-hydroxy-3-(4-iodophenoxy)-4H-chromen-4-one
CAS: 196928-50-4
CID: 5428913
Formula: C15H9IO4
MW: 380.13
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight380.13
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass379.95456
Monoisotopic Mass379.95456
Topological Polar Surface Area55.8 Ų
Heavy Atom Count20
Formal Charge0
Complexity401
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
M27492-01XAP044
WHA92850-01MGlu7 Antagonist, XAP044

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