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Screening compounds

Gbr-13069

Also known as Gbr 13069, GBR-12879 dimesylate, Piperazine, 1-(2-(bis(4-fluorophenyl)methoxy)ethyl)-4-(3-phenyl-2-propenyl)-, dimethanesulfonate

CAS 77862-93-2Formula C30H38F2N2O7S2Molar mass 640.77 g/mol
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Gbr-13069 chemical structure, C30H38F2N2O7S2, CAS 77862-93-2
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
77862-93-2
Formula
C30H38F2N2O7S2
Molar mass
640.77 g/mol
HS code
293359
Category
Screening compounds

What is Gbr-13069?

Plain description, key identifiers and synonyms

Gbr-13069 is a chemical substance with the molecular formula C30H38F2N2O7S2 and a molar mass of 640.77 g/mol. Its CAS registry number is 77862-93-2. The IUPAC name is 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazine, methanesulfonic acid.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazine, methanesulfonic acid
CAS number
77862-93-2
Molecular formula
C30H38F2N2O7S2
UNII
9B7G9F1T4T
InChIKey
GETNYSZHXJZOLF-RDRKJGRWSA-N
InChI
InChI=1S/C28H30F2N2O.2CH4O3S/c29-26-12-8-24(9-13-26)28(25-10-14-27(30)15-11-25)33-22-21-32-19-17-31(18-20-32)16-4-7-23-5-2-1-3-6-23;2*1-5(2,3)4/h1-15,28H,16-22H2;2*1H3,(H,2,3,4)/b7-4+;;
Canonical SMILES
CS(=O)(=O)O.CS(=O)(=O)O.Fc1ccc(C(OCCN2CCN(CC=Cc3ccccc3)CC2)c2ccc(F)cc2)cc1
Isomeric SMILES
CS(=O)(=O)O.CS(=O)(=O)O.C1CN(CCN1CCOC(C2=CC=C(C=C2)F)C3=CC=C(C=C3)F)C/C=C/C4=CC=CC=C4

Synonyms

  • Gbr 13069
  • GBR-12879 dimesylate
  • Piperazine, 1-(2-(bis(4-fluorophenyl)methoxy)ethyl)-4-(3-phenyl-2-propenyl)-, dimethanesulfonate
  • Piperazine, 1-(2-(bis(4-fluorophenyl)methoxy)ethyl)-4-(3-phenyl-2-propen-1-yl)-, methanesulfonate (1:2)
  • GBR-12879 (methanesulfonate)

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
640.77 g/molcalc.
Exact mass
640.2089 Dacalc.
LogP (octanol/water)
4.41calc.
Topological polar surface area
124.5 Ųcalc.
Hydrogen bond donors
2calc.
Hydrogen bond acceptors
7calc.
Rotatable bonds
9calc.
Heavy atoms
43calc.
Rings
4calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.33calc.
Formal charge
0calc.
Stereocentres
0calc.
Components
3calc.
Lipinski rule of five
Passes (1 violation)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, C(=Cc1ccccc1)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1

C(=Cc1ccccc1)CN1CCN(CCOC(c2ccccc2)c2ccccc2)CC1

4 rings, 31 atoms.

13 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.

Gbr-13069 suppliers

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Gbr-13069 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 Gbr-13069 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 Gbr-13069 is indicative (it was assigned by structure rules). Confirm the classification with your customs broker before shipping.

Frequently asked questions

Quick answers about Gbr-13069, based on the data on this page

What is Gbr-13069?

Gbr-13069 is a chemical substance with the molecular formula C30H38F2N2O7S2 and a molar mass of 640.77 g/mol. Its CAS registry number is 77862-93-2. The IUPAC name is 1-[2-[bis(4-fluorophenyl)methoxy]ethyl]-4-[(E)-3-phenylprop-2-enyl]piperazine, methanesulfonic acid.

What is the CAS number of Gbr-13069?

The CAS registry number of Gbr-13069 is 77862-93-2.

What is the molecular formula and weight of Gbr-13069?

The molecular formula of Gbr-13069 is C30H38F2N2O7S2 and its molar mass is 640.77 g/mol.

What is Gbr-13069 used for?

Known uses and roles of Gbr-13069 include building blocks in research and laboratory and screening compounds in research and laboratory.

Is Gbr-13069 hazardous?

No GHS hazard classification for Gbr-13069 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 Gbr-13069?

Gbr-13069 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 Gbr-13069?

Post a free request on CompoundList and suppliers of Gbr-13069 will send you quotes. Your contact details stay private until you accept a quote.

What is the price of Gbr-13069?

Suppliers quote Gbr-13069 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 Gbr-13069

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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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