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Screening compounds

Hydroxypropentofylline

Also known as 1H-Purine-2,6-dione, 3,7-dihydro-7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)-, 7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)-3,7-dihydro-1H-purine-2,6-dione

CAS 104317-70-6Formula C15H22N4O4Molar mass 322.37 g/mol
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Hydroxypropentofylline chemical structure, C15H22N4O4, CAS 104317-70-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
104317-70-6
Formula
C15H22N4O4
Molar mass
322.37 g/mol
HS code
293359
Category
Screening compounds

What is Hydroxypropentofylline?

Plain description, key identifiers and synonyms

Hydroxypropentofylline is a chemical substance with the molecular formula C15H22N4O4 and a molar mass of 322.37 g/mol. Its CAS registry number is 104317-70-6. The IUPAC name is 7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione
CAS number
104317-70-6 CAS number cross-checked
Molecular formula
C15H22N4O4
InChIKey
HNFYOKRWFUQBIE-UHFFFAOYSA-N
InChI
InChI=1S/C15H22N4O4/c1-10(20)6-4-5-7-19-14(22)12-13(17(3)15(19)23)16-9-18(12)8-11(2)21/h9,11,21H,4-8H2,1-3H3
SMILES (canonical and isomeric)
CC(CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCC(=O)C)O

Synonyms

  • 1H-Purine-2,6-dione, 3,7-dihydro-7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)-
  • 7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)-3,7-dihydro-1H-purine-2,6-dione

Physical and chemical properties

Measured values and descriptors computed from the structure

Physical and chemical properties

Measured values, check the supplier specification for your grade

No measured properties are recorded for this substance yet. Ask suppliers for a technical data sheet.

Values vary by grade. Ask suppliers for the COA or TDS of the batch you buy.

Computed descriptors

Calculated from the structure, useful for screening and formulation

Molecular weight
322.37 g/molcalc.
Exact mass
322.1641 Dacalc.
LogP (octanol/water)
0.04calc.
Topological polar surface area
99.12 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
5calc.
Rotatable bonds
7calc.
Heavy atoms
23calc.
Rings
2calc.
Aromatic rings
2calc.
Fraction sp3 carbons
0.6calc.
Formal charge
0calc.
Stereocentres
1calc.
Lipinski rule of five
Passes (0 violations)calc.

Calculated for screening. Confirm critical figures with the supplier.

Murcko scaffold

The ring system that remains when every side chain is removed

Murcko scaffold of this chemical, O=c1[nH]c(=O)c2[nH]cnc2[nH]1

O=c1[nH]c(=O)c2[nH]cnc2[nH]1

2 rings, 11 atoms, the Xanthine ring system.

1,880 other chemicals share this scaffold

Safety and hazards

GHS classification summary, not a safety data sheet

No GHS hazard classification is recorded for this substance yet. That does not mean it is harmless.

GHS classification summary, not a safety data sheet (SDS). Classifications can differ by supplier, grade and concentration. Always check the supplier's SDS.

Hydroxypropentofylline suppliers

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Hydroxypropentofylline price

Indicative price range per kg from live supplier offers

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Uses and applications

What the substance is used for, by industry and function

Regulatory status

Inventories, regulations and trade controls that list this substance

No regulatory list memberships are recorded for this substance yet. Always check the rules of the importing and exporting country before trade.

HS code and trade data

Customs classification and reported world trade statistics

Global trade

World import and export statistics for the HS code Hydroxypropentofylline is traded under.

HS 2933.59Indicative HS code

Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring, other

World exports in 2024
$18.4B
+10.5% vs 2023, imports $24.8B
2019 to 2024
Top exporters
  1. Ireland43.6%
  2. Switzerland * partner reported26.3%
  3. China7.9%
Top importers
  1. Slovenia30.3%
  2. United States30.1%
  3. Germany15.3%

* Partner reported figures, a lower bound.

Reported customs values in USD, not prices.Full trade data

The HS code shown for Hydroxypropentofylline is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Hydroxypropentofylline, based on the data on this page

What is Hydroxypropentofylline?

Hydroxypropentofylline is a chemical substance with the molecular formula C15H22N4O4 and a molar mass of 322.37 g/mol. Its CAS registry number is 104317-70-6. The IUPAC name is 7-(2-hydroxypropyl)-3-methyl-1-(5-oxohexyl)purine-2,6-dione.

What is the CAS number of Hydroxypropentofylline?

The CAS registry number of Hydroxypropentofylline is 104317-70-6.

What is the molecular formula and weight of Hydroxypropentofylline?

The molecular formula of Hydroxypropentofylline is C15H22N4O4 and its molar mass is 322.37 g/mol.

What is Hydroxypropentofylline used for?

Known uses and roles of Hydroxypropentofylline include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Hydroxypropentofylline hazardous?

No GHS hazard classification for Hydroxypropentofylline is recorded on CompoundList yet. That does not prove it is safe. Always read the supplier safety data sheet.

What is the HS code of Hydroxypropentofylline?

Hydroxypropentofylline is usually classified under HS code 293359 (Compounds containing a pyrimidine ring (whether or not hydrogenated) or piperazine ring…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Hydroxypropentofylline?

Post a free request on CompoundList and suppliers of Hydroxypropentofylline will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Hydroxypropentofylline?

Suppliers quote Hydroxypropentofylline on request because prices depend on grade, purity, quantity and destination. A free request on CompoundList gets you several quotes to compare.

Guides for buyers

Practical guides that help when you source, ship or handle Hydroxypropentofylline

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Data last updated 7 Oct 2026. Details may have changed, please confirm them with the supplier. Report an error on this page
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