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Screening compounds

Anticancer agent 72

CAS 2460167-51-3Formula C20H19N7O2Molar mass 389.42 g/mol
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Anticancer agent 72 chemical structure, C20H19N7O2, CAS 2460167-51-3
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
2460167-51-3
Formula
C20H19N7O2
Molar mass
389.42 g/mol
HS code
293359
Category
Screening compounds

What is Anticancer agent 72?

Plain description, key identifiers and synonyms

Anticancer agent 72 is a chemical substance with the molecular formula C20H19N7O2 and a molar mass of 389.42 g/mol. Its CAS registry number is 2460167-51-3. The IUPAC name is 6-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
6-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine
CAS number
2460167-51-3
Molecular formula
C20H19N7O2
InChIKey
BZSZQLYSCIYBNH-UHFFFAOYSA-N
InChI
InChI=1S/C20H19N7O2/c1-24-10-12-25(13-11-24)20-17-5-3-2-4-16(17)19-22-21-18(26(19)23-20)14-6-8-15(9-7-14)27(28)29/h2-9H,10-13H2,1H3
SMILES (canonical and isomeric)
CN1CCN(CC1)C2=NN3C(=NN=C3C4=CC=CC=C42)C5=CC=C(C=C5)[N+](=O)[O-]

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
389.42 g/molcalc.
Exact mass
389.16 Dacalc.
LogP (octanol/water)
2.6calc.
Topological polar surface area
92.7 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
7calc.
Rotatable bonds
3calc.
Heavy atoms
29calc.
Rings
5calc.
Aromatic rings
4calc.
Fraction sp3 carbons
0.25calc.
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, c1ccc(-c2nnc3c4ccccc4c(N4CCNCC4)nn23)cc1

c1ccc(-c2nnc3c4ccccc4c(N4CCNCC4)nn23)cc1

5 rings, 25 atoms.

1 other chemical 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.

Anticancer agent 72 suppliers

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Anticancer agent 72 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 Anticancer agent 72 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 Anticancer agent 72 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Anticancer agent 72, based on the data on this page

What is Anticancer agent 72?

Anticancer agent 72 is a chemical substance with the molecular formula C20H19N7O2 and a molar mass of 389.42 g/mol. Its CAS registry number is 2460167-51-3. The IUPAC name is 6-(4-methylpiperazin-1-yl)-3-(4-nitrophenyl)-[1,2,4]triazolo[3,4-a]phthalazine.

What is the CAS number of Anticancer agent 72?

The CAS registry number of Anticancer agent 72 is 2460167-51-3.

What is the molecular formula and weight of Anticancer agent 72?

The molecular formula of Anticancer agent 72 is C20H19N7O2 and its molar mass is 389.42 g/mol.

What is Anticancer agent 72 used for?

Known uses and roles of Anticancer agent 72 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Anticancer agent 72 hazardous?

No GHS hazard classification for Anticancer agent 72 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 Anticancer agent 72?

Anticancer agent 72 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 Anticancer agent 72?

Post a free request on CompoundList and suppliers of Anticancer agent 72 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Anticancer agent 72?

Suppliers quote Anticancer agent 72 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

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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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