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Screening compounds

Basroparib

Also known as 5-(4-(2,6-Difluoro-4-(2-methoxyethoxy)phenyl)piperazin-1-yl)-3-methyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one, 5-[4-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-3-methyl-6H-triazolo[4,5-d]pyrimidin-7-one, 7H-1,2,3-Triazolo(4,5-d)pyrimidin-7-one, 5-(4-(2,6-difluoro-4-(2-methoxyethoxy)phenyl)-1-piperazinyl)-3,6-dihydro-3-methyl-

CAS 1858179-75-5Formula C18H21F2N7O3Molar mass 421.41 g/mol
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Basroparib chemical structure, C18H21F2N7O3, CAS 1858179-75-5
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1858179-75-5
Formula
C18H21F2N7O3
Molar mass
421.41 g/mol
HS code
293359
Category
Screening compounds

What is Basroparib?

Plain description, key identifiers and synonyms

Basroparib is an orally bioavailable inhibitor of the poly (ADP-ribose) polymerase (PARP) enzyme tankyrase, with potential antineoplastic activity. Upon administration, basroparib selectively binds to and inhibits the activity of tankyrase. This may block the tankyrase-mediated poly(ADP-ribosyl)ation of multiple target proteins including various tumor suppressors. This may include the blockage of the poly(ADP-ribosyl)ation and destabilization of AXIN, a negative regulator of beta-catenin, and prevents Wnt/beta-catenin signaling. This may inhibit the activation of transcription of a wide range of target genes of Wnt/beta-catenin signaling, thereby preventing gene expression of many Wnt-related, pro-survival proteins and suppressing tumor cell growth. Tankyrase, a member of the PARP family, plays an important role in the regulation of the Wnt/beta-catenin signaling pathway, tumor suppressors, as well as telomere maintenance and mitosis regulation.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
5-[4-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-3-methyl-6H-triazolo[4,5-d]pyrimidin-7-one
CAS number
1858179-75-5
Molecular formula
C18H21F2N7O3
UNII
P5LYN8CD74
InChIKey
ALDDPEMJJONRDI-UHFFFAOYSA-N
InChI
InChI=1S/C18H21F2N7O3/c1-25-16-14(23-24-25)17(28)22-18(21-16)27-5-3-26(4-6-27)15-12(19)9-11(10-13(15)20)30-8-7-29-2/h9-10H,3-8H2,1-2H3,(H,21,22,28)
SMILES (canonical and isomeric)
CN1C2=C(C(=O)NC(=N2)N3CCN(CC3)C4=C(C=C(C=C4F)OCCOC)F)N=N1

Synonyms

  • 5-(4-(2,6-Difluoro-4-(2-methoxyethoxy)phenyl)piperazin-1-yl)-3-methyl-3,6-dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
  • 5-[4-[2,6-difluoro-4-(2-methoxyethoxy)phenyl]piperazin-1-yl]-3-methyl-6H-triazolo[4,5-d]pyrimidin-7-one
  • 7H-1,2,3-Triazolo(4,5-d)pyrimidin-7-one, 5-(4-(2,6-difluoro-4-(2-methoxyethoxy)phenyl)-1-piperazinyl)-3,6-dihydro-3-methyl-
  • 5-(4-(2,6-Difluoro-4-(2- methoxyethoxy)phenyl)piperazin-1-yl)-3-methyl-3,6- dihydro-7H-(1,2,3)triazolo(4,5-d)pyrimidin-7-one
  • 5-(4-(2,6-Difluoro-4-(2-methoxyethoxy)phenyl)-1-piperazinyl)-3,6-dihydro-3-methyl-7H-1,2,3-triazolo(4,5-d)pyrimidin-7-one
  • 5-[4-[2,6-Difluoro-4-(2-methoxyethoxy)phenyl]-1-piperazinyl]-3,6-dihydro-3-methyl-7H-1,2,3-triazolo[4,5-d]pyrimidin-7-one
  • 5-{4-[2,6-difluoro-4-(2- methoxyethoxy)phenyl]piperazin-1-yl}-3-methyl-3,6- dihydro-7H-[1,2,3]triazolo[4,5-d]pyrimidin-7-one
  • 5-(4-(2,6-difluoro-4-(2-methoxyethoxy)phenyl)piperazin-1-yl)-3-methyl-3,6-dihydro-7H-[1,2,3]triazolo [4,5-d]pyrimidin-7-one

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
421.41 g/molcalc.
Exact mass
421.1674 Dacalc.
LogP (octanol/water)
0.68calc.
Topological polar surface area
101.4 Ųcalc.
Hydrogen bond donors
1calc.
Hydrogen bond acceptors
8calc.
Rotatable bonds
6calc.
Heavy atoms
30calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.44calc.
Formal charge
0calc.
Stereocentres
0calc.
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(N2CCN(c3ccccc3)CC2)nc2[nH]nnc12

O=c1[nH]c(N2CCN(c3ccccc3)CC2)nc2[nH]nnc12

4 rings, 22 atoms.

No other chemical in our database has 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.

Basroparib suppliers

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Basroparib 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

Roles

  • antineoplastic agent
  • pharmaceutical

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 Basroparib 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 Basroparib is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

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

What is Basroparib?

Basroparib is an orally bioavailable inhibitor of the poly (ADP-ribose) polymerase (PARP) enzyme tankyrase, with potential antineoplastic activity. Upon administration, basroparib selectively binds to and inhibits the activity of tankyrase.

What is the CAS number of Basroparib?

The CAS registry number of Basroparib is 1858179-75-5.

What is the molecular formula and weight of Basroparib?

The molecular formula of Basroparib is C18H21F2N7O3 and its molar mass is 421.41 g/mol.

What is Basroparib used for?

Known uses and roles of Basroparib include building blocks in research and laboratory, screening compounds in research and laboratory, antineoplastic agent and pharmaceutical.

Is Basroparib hazardous?

No GHS hazard classification for Basroparib 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 Basroparib?

Basroparib 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 Basroparib?

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

What is the price of Basroparib?

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

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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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