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KFM19

CAT: 0931-T15655-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T15655-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
133058-72-7
Target
Adenosine Receptor
Related Pathways
GPCR/G Protein, Neuroscience
Purity
0.9918
Bioactivity
KFM19 is a potent and selective adenosine receptor (A1-receptor) antagonist (IC50 : 50 nM) for the study of neurological disorders.
Smiles
CCCn1c2[nH]c(nc2c(=O)n(CCC)c1=O)C1CCC(=O)C1
Molecular Formula
C16H22N4O3
Molecular Weight
318.37
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Kfm 19

a potential cognitive enhancer and a selective adenosine A1 receptor antagonist

CAS Number133058-72-7
PubChem CID131584
IUPAC Name8-(3-oxocyclopentyl)-1,3-dipropyl-7H-purine-2,6-dione
Molecular FormulaC16H22N4O3
Molecular Weight318.37
XLogP2.2
Topological Polar Surface Area86.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count23
Formal Charge0
Complexity510
SMILES
CCCN1C2=C(C(=O)N(C1=O)CCC)NC(=N2)C3CCC(=O)C3
InChI
InChI=1S/C16H22N4O3/c1-3-7-19-14-12(15(22)20(8-4-2)16(19)23)17-13(18-14)10-5-6-11(21)9-10/h10H,3-9H2,1-2H3,(H,17,18)
InChIKey
RUHGOZFOVBMWOO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Kfm 19
CAS: 133058-72-7
CID: 131584
Formula: C16H22N4O3
MW: 318.37
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight318.37
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass318.16919058
Monoisotopic Mass318.16919058
Topological Polar Surface Area86.4 Ų
Heavy Atom Count23
Formal Charge0
Complexity510
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS5769246KFM19

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