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Screening compounds

Tegobuvir

Also known as 5-((6-(2,4-bis(Trifluoromethyl)phenyl)pyridazin-3-yl)methyl)-2-(2-fluorophenyl)-5H-imidazo[4,5-c]pyridine, 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine, 5-({6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl}methyl)-2-(2-fluorophenyl)-5h-imidazo[4,5-c]pyridine

CAS 1000787-75-6Formula C25H14F7N5Molar mass 517.41 g/mol
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Tegobuvir chemical structure, C25H14F7N5, CAS 1000787-75-6
2D chemical structure

Key facts

What buyers check first

All properties
CAS number
1000787-75-6
Formula
C25H14F7N5
Molar mass
517.41 g/mol
HS code
293399
Category
Screening compounds

What is Tegobuvir?

Plain description, key identifiers and synonyms

Tegobuvir is a chemical substance with the molecular formula C25H14F7N5 and a molar mass of 517.41 g/mol. Its CAS registry number is 1000787-75-6. The IUPAC name is 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine.

Identifiers

Registry numbers, names and line notations, tap to copy

IUPAC name
5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
CAS number
1000787-75-6 CAS number cross-checkedOther or deprecated CAS: 100078-77-1
Molecular formula
C25H14F7N5
UNII
5NOK5X389M
MDL number
MFCD18251457
InChIKey
XBEQSQDCBSKCHJ-UHFFFAOYSA-N
InChI
InChI=1S/C25H14F7N5/c26-19-4-2-1-3-17(19)23-33-21-9-10-37(13-22(21)34-23)12-15-6-8-20(36-35-15)16-7-5-14(24(27,28)29)11-18(16)25(30,31)32/h1-11,13H,12H2
SMILES (canonical and isomeric)
C1=CC=C(C(=C1)C2=NC3=CN(C=CC3=N2)CC4=NN=C(C=C4)C5=C(C=C(C=C5)C(F)(F)F)C(F)(F)F)F

Synonyms

  • 5-((6-(2,4-bis(Trifluoromethyl)phenyl)pyridazin-3-yl)methyl)-2-(2-fluorophenyl)-5H-imidazo[4,5-c]pyridine
  • 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine
  • 5-({6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl}methyl)-2-(2-fluorophenyl)-5h-imidazo[4,5-c]pyridine
  • tegobuvirum
  • 5-((6-(2,4-Bis(trifluoromethyl)phenyl)pyridazin-3-yl)methyl)-2-(2-fluorophenyl)-5H-imidazo(4,5-c)pyridine
  • 5-((6-(2,4-bis(trifluoromethyl)phenyl)pyridazin-3-yl)methyl)-2-(2-fluorophenyl)imidazo(4,5-c)pyridine
  • GS 9190
  • 3-[2,4-bis(trifluoromethyl)phenyl]-6-{[2-(2-fluorophenyl)-5H-imidazo[4,5-c]pyridin-5-yl]methyl}pyridazine
  • 5H-Imidazo(4,5-c)pyridine, 5-((6-(2,4-bis(trifluoromethyl)phenyl)-3-pyridazinyl)methyl)- 2-(2-fluorophenyl)-
  • GS 333126
  • Tegobuvir (USAN/INN)
  • Tegobuvir (GS-9190, GS 333126)?
  • 5H-Imidazo[4,5-c]pyridine, 5-[[6-[2,4-bis(trifluoromethyl)phenyl]-3-pyridazinyl]methyl]-2-(2-fluorophenyl)-

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
517.41 g/molcalc.
Exact mass
517.1137 Dacalc.
LogP (octanol/water)
6.73calc.
Topological polar surface area
56.49 Ųcalc.
Hydrogen bond donors
0calc.
Hydrogen bond acceptors
4calc.
Rotatable bonds
4calc.
Heavy atoms
37calc.
Rings
5calc.
Aromatic rings
3calc.
Fraction sp3 carbons
0.12calc.
Formal charge
0calc.
Stereocentres
0calc.
Lipinski rule of five
Fails (2 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(-c2ccc(Cn3ccc4nc(-c5ccccc5)nc-4c3)nn2)cc1

c1ccc(-c2ccc(Cn3ccc4nc(-c5ccccc5)nc-4c3)nn2)cc1

5 rings, 28 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.

Tegobuvir suppliers

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Where suppliers are based

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Tegobuvir price

Indicative price range per kg from live supplier offers

No published prices right now

Suppliers quote this chemical on request. Send one free request and compare quotes side by side.

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Uses and applications

What the substance is used for, by industry and function

Roles

  • antimicrobial agent
  • antiviral agent

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 Tegobuvir is traded under.

HS 2933.99Indicative HS code

Heterocyclic compounds with nitrogen hetero-atom(s) only, other

World exports in 2024
$12.1B
−31.0% vs 2023, imports $28.8B
2019 to 2024
Top exporters
  1. China30.5%
  2. India * partner reported16.3%
  3. Ireland9.0%
Top importers
  1. Slovenia31.7%
  2. Italy24.2%
  3. United States5.0%

* Partner reported figures, a lower bound.

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

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

Frequently asked questions

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

What is Tegobuvir?

Tegobuvir is a chemical substance with the molecular formula C25H14F7N5 and a molar mass of 517.41 g/mol. Its CAS registry number is 1000787-75-6. The IUPAC name is 5-[[6-[2,4-bis(trifluoromethyl)phenyl]pyridazin-3-yl]methyl]-2-(2-fluorophenyl)imidazo[4,5-c]pyridine.

What is the CAS number of Tegobuvir?

The CAS registry number of Tegobuvir is 1000787-75-6. Other or deprecated CAS numbers: 100078-77-1.

What is the molecular formula and weight of Tegobuvir?

The molecular formula of Tegobuvir is C25H14F7N5 and its molar mass is 517.41 g/mol.

What is Tegobuvir used for?

Known uses and roles of Tegobuvir include building blocks in research and laboratory, screening compounds in research and laboratory, antimicrobial agent and antiviral agent.

Is Tegobuvir hazardous?

No GHS hazard classification for Tegobuvir 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 Tegobuvir?

Tegobuvir is usually classified under HS code 293399 (Heterocyclic compounds with nitrogen hetero-atom(s) only, other). This is indicative, confirm it with your customs broker before shipping.

Where can I buy Tegobuvir?

CompoundList lists 1 supplier of Tegobuvir in China. Send one free request to get and compare quotes. Your contact details stay private until you accept a quote.

What is the price of Tegobuvir?

Suppliers quote Tegobuvir 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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