Structure

Pentoxifylline

CAS
6493-05-6
Catalog Number
ACM6493056
Category
Inhibitors
Molecular Weight
278.31
Molecular Formula
C13H18N4O3

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Specification

Description
Pentoxifylline (BL-191), a haemorheological agent, is an orally active non-selective phosphodiesterase (PDE) inhibitor, with immune modulation, anti-inflammatory, hemorheological, anti-fibrinolytic and anti-proliferation effects. Pentoxifylline can be used for the research of peripheral vascular disease, cerebrovascular disease and a number of other conditions involving a defective regional microcirculation.
Synonyms
TRENTAL;1-(5-Oxohexyl)-3,7-dimethylxanthine;1-(5-oxohexyl)-theobromin;1-(5-Oxohexyl)theobromine;1-(5-oxohexyl)-Theobromine;1H-Purine-2,6-dione, 3,7-dihydro-3,7-dimethyl-1-(5-oxohexyl)-;3,7-dihydro-3,7-dimethyl-1-(5-oxohexyl)-1h-purine-6-dione;3,7-Dimethyl-1-(5-oxohexyl)-1H,3H-purin-2,6-dione
Canonical SMILES
O=C(N1CCCCC(C)=O)N(C)C2=C(N(C)C=N2)C1=O
Melting Point
98-100°C
Appearance
solid
Storage
Powder-20°C, 3 years; 4°C, 2 years; In solvent-80°C, 6 months; -20°C, 1 month.
Hazard Statements
Xn
Safety Description
36
Shipping
Can be shipped at room temperature, where not in use may vary.
What is the molecular formula of pentoxifylline?

The molecular formula of pentoxifylline is C13H18N4O3.

What is the molecular weight of pentoxifylline?

The molecular weight of pentoxifylline is 278.31 g/mol.

What is the IUPAC name of pentoxifylline?

The IUPAC name of pentoxifylline is 3,7-dimethyl-1-(5-oxohexyl)purine-2,6-dione.

What is the InChI of pentoxifylline?

The InChI of pentoxifylline is InChI=1S/C13H18N4O3/c1-9(18)6-4-5-7-17-12(19)10-11(14-8-15(10)2)16(3)13(17)20/h8H,4-7H2,1-3H3.

What is the InChIKey of pentoxifylline?

The InChIKey of pentoxifylline is BYPFEZZEUUWMEJ-UHFFFAOYSA-N.

What is the CAS number of pentoxifylline?

The CAS number of pentoxifylline is 6493-05-6.

What is the EC number of pentoxifylline?

The EC number of pentoxifylline is 229-374-5.

What is the ChEMBL ID of pentoxifylline?

The ChEMBL ID of pentoxifylline is CHEMBL628.

What is the UNII of pentoxifylline?

The UNII of pentoxifylline is SD6QCT3TSU.

What is the Wikipedia page for pentoxifylline?

The Wikipedia page for pentoxifylline is "Pentoxifylline".

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