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Propentofylline

CAT: 1410-M33635-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M33635-01Size:5 mg
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Description
Propentofylline (Hextol) is a methylxanthine derivative with neuroprotective, antiproliferative, and anti-inflammatory activity and enhanced synaptic adenosine signaling, which may be useful in the study of Alzheimer's disease, vascular dementia, cognitive impairment, dementia, and chronic pain.
CAS Number
55242-55-2
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
306.36
Molecular Formula
C15H22N4O3
Notes
Research use only, not for human use.
Receptor
PDE

Chemical Information

Propentofylline

Propentofylline is an oxopurine.

CAS Number55242-55-2
PubChem CID4938
IUPAC Name3-methyl-1-(5-oxohexyl)-7-propylpurine-2,6-dione
Molecular FormulaC15H22N4O3
Molecular Weight306.36
XLogP0.7
Topological Polar Surface Area75.5
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Heavy Atom Count22
Formal Charge0
Complexity454
SMILES
CCCN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(=O)C
InChI
InChI=1S/C15H22N4O3/c1-4-8-18-10-16-13-12(18)14(21)19(15(22)17(13)3)9-6-5-7-11(2)20/h10H,4-9H2,1-3H3
InChIKey
RBQOQRRFDPXAGN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Propentofylline
CAS: 55242-55-2
CID: 4938
Formula: C15H22N4O3
MW: 306.36
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight306.36
XLogP30.7
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count4
Rotatable Bond Count7
Exact Mass306.16919058
Monoisotopic Mass306.16919058
Topological Polar Surface Area75.5 Ų
Heavy Atom Count22
Formal Charge0
Complexity454
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
FP27197-01Propentofylline
HY-107203S-01Propentofylline-d6
463054Propentofylline-d7
AR-P03072-01Hydroxy Propentofylline
sc-488198Rac 5-Hydroxy Propentofylline

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