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Xininurad

CAT: 0607-BA7069-1Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0607-BA7069-1Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2365178-28-3
Form
A solid
Molecular Formula
C15H10Br2FN3O2
Molecular Weight
443.07
Shipping Conditions
Blue ice
Storage Conditions
4°C, desiccated and protect from light.

Chemical Information

Xininurad

Xininurad is a small molecule drug. The usage of the INN stem '-inurad' in the name indicates that Xininurad is a urate transporter inhibitor. Xininurad has a monoisotopic molecular weight of 440.91 Da.

CAS Number2365178-28-3
PubChem CID139329673
IUPAC Name(3,5-dibromo-4-hydroxyphenyl)-(2-ethyl-6-fluoroimidazo[1,2-a]pyrimidin-3-yl)methanone
Molecular FormulaC15H10Br2FN3O2
Molecular Weight443.06
XLogP4.7
Topological Polar Surface Area67.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Heavy Atom Count23
Formal Charge0
Complexity446
SMILES
CCC1=C(N2C=C(C=NC2=N1)F)C(=O)C3=CC(=C(C(=C3)Br)O)Br
InChI
InChI=1S/C15H10Br2FN3O2/c1-2-11-12(21-6-8(18)5-19-15(21)20-11)13(22)7-3-9(16)14(23)10(17)4-7/h3-6,23H,2H2,1H3
InChIKey
ACXPMDYWZAUOJS-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Xininurad
CAS: 2365178-28-3
CID: 139329673
Formula: C15H10Br2FN3O2
MW: 443.06
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight443.06
XLogP34.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count3
Exact Mass442.91033
Monoisotopic Mass440.91238
Topological Polar Surface Area67.5 Ų
Heavy Atom Count23
Formal Charge0
Complexity446
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
GTR19186003-01Xininurad

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