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Screening compounds

Itazigrel

Also known as Itazigrelum, Thiazole, 4,5-bis(4-methoxyphenyl)-2-(trifluoromethyl)-, LY 108048

CAS 70529-35-0Formula C18H14F3NO2SMolar mass 365.38 g/mol
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Itazigrel chemical structure, C18H14F3NO2S, CAS 70529-35-0
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
70529-35-0
Formula
C18H14F3NO2S
Molar mass
365.38 g/mol
HS code
293410
Category
Screening compounds

What is Itazigrel?

Plain description, key identifiers and synonyms

Itazigrel is a chemical substance with the molecular formula C18H14F3NO2S and a molar mass of 365.38 g/mol. Its CAS registry number is 70529-35-0. The IUPAC name is 4,5-bis(4-methoxyphenyl)-2-(trifluoromethyl)-1,3-thiazole.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
4,5-bis(4-methoxyphenyl)-2-(trifluoromethyl)-1,3-thiazole
CAS number
70529-35-0 CAS number cross-checked
Molecular formula
C18H14F3NO2S
UNII
N835I8CXY0
InChIKey
CIPBQTCSXVEDSG-UHFFFAOYSA-N
InChI
InChI=1S/C18H14F3NO2S/c1-23-13-7-3-11(4-8-13)15-16(25-17(22-15)18(19,20)21)12-5-9-14(24-2)10-6-12/h3-10H,1-2H3
SMILES (canonical and isomeric)
COC1=CC=C(C=C1)C2=C(SC(=N2)C(F)(F)F)C3=CC=C(C=C3)OC

Synonyms

  • Itazigrelum
  • Thiazole, 4,5-bis(4-methoxyphenyl)-2-(trifluoromethyl)-
  • LY 108048
  • 4,5-Bis(4-methoxyphenyl)-2-trifluoromethylthiazole
  • 4,5-bis(4-methoxyphenyl)-2-(trifluoromethyl)thiazole
  • 2-trifluoromethyl-4,5-bis(4-methoxyphenyl)thiazole
  • 4,5-BMTT
  • 4,5-bis(4-methoxyphenyl)-2-(trifluoromethyl)-1,3-thiazole
  • 4,5-bis(p-Methoxyphenyl)-2-(trifluoromethyl)thiazole
  • Itazogrel
  • LY 108048, U 53059
  • Itazigrel (USAN/INN)

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
365.38 g/molcalc.
Exact mass
365.0697 Dacalc.
LogP (octanol/water)
5.51calc.
Topological polar surface area
31.35 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
4calc.
Heavy atoms
25calc.
Rings
3calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.17calc.
Formal charge
0calc.
Stereocentres
0calc.
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, c1ccc(-c2ncsc2-c2ccccc2)cc1

c1ccc(-c2ncsc2-c2ccccc2)cc1

3 rings, 17 atoms, the 4,5-Diphenyl-1,3-thiazole ring system.

52 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.

Itazigrel suppliers

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Itazigrel 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 Itazigrel is traded under.

HS 2934.10Indicative HS code

Compounds containing an unfused thiazole ring (whether or not hydrogenated) in the…

World exports in 2024
$3.88B
−16.1% vs 2023, imports $3.12B
2019 to 2024
Top exporters
  1. Switzerland * partner reported36.4%
  2. Ireland28.8%
  3. China10.0%
Top importers
  1. Canada33.4%
  2. United States14.4%
  3. Ireland13.1%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Itazigrel?

Itazigrel is a chemical substance with the molecular formula C18H14F3NO2S and a molar mass of 365.38 g/mol. Its CAS registry number is 70529-35-0. The IUPAC name is 4,5-bis(4-methoxyphenyl)-2-(trifluoromethyl)-1,3-thiazole.

What is the CAS number of Itazigrel?

The CAS registry number of Itazigrel is 70529-35-0.

What is the molecular formula and weight of Itazigrel?

The molecular formula of Itazigrel is C18H14F3NO2S and its molar mass is 365.38 g/mol.

What is Itazigrel used for?

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

Is Itazigrel hazardous?

No GHS hazard classification for Itazigrel 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 Itazigrel?

Itazigrel is usually classified under HS code 293410 (Compounds containing an unfused thiazole ring (whether or not hydrogenated) in the…). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Itazigrel?

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

What is the price of Itazigrel?

Suppliers quote Itazigrel 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 Itazigrel

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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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