Gardiquimod diTFA - ≥99% , CAS No.1159840-61-5

CAS: 1159840-61-5 Cat. No.: G647706 Molecular Weight: 541.4 PubChem CID: 44592365
AVAILABLE TO ORDER
GRADE & PURITY ≥99%
Synonyms
1H-Imidazo[4,5-c]quinoline-1-ethanol, 4-amino-2-[(ethylamino)methyl]-alpha,alpha-dimethyl-, 2,2,2-trifluoroacetate (1:2) | 4Y6M4HJ0WU | 1H-IMIDAZO(4,5-C)QUINOLINE-1-ETHANOL, 4-AMINO-2-((ETHYLAMINO)METHYL)-.ALPHA.,.ALPHA.-DIMETHYL-, 2,2,2-TRIFLUOROACETATE
Storage
Store at 2-8°C,Desiccated
Shipped In
Wet ice
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G647706-5mg
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Why this grade

≥99% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Store at 2-8°C,Desiccated Ships Wet ice Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Overview

Gardiquimod diTFA, an imidazoquinoline analog, is a TLR7/8 agonist. Gardiquimod diTFA could inhibit HIV-1 infection of macrophages and activated peripheral blood mononuclear cells (PBMCs). Gardiquimod diTFA specifically activates TLR7 when used at concentrations below 10 μM

In Vitro

Gardiquimod diTFA (6-60 μM ) significantly inhibits cDNA synthesis by HIV-1 reverse transcriptase. MCE has not independently confirmed the accuracy of these methods. They are for reference only.

In Vivo

Dendritic cells (DCs) in combination with Gardiquimod (1 mg/kg per mouse; i.p.; daily for 7 days) improves the anti-tumor effects of NK cells. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Animal Model: Male athymic nude mice (Balb-nu/nu, 5 weeks old) (bearing human HepG2 liver carcinoma xenografts)Dosage: 1 mg/kg per mouse Administration: i.p.; daily for 7 days Result: Significantly suppressed the growth of human HepG2 liver carcinoma xenografts.

Form:Solid

IC50& Target:TLR7 TLR8 HIV-1

Specifications

Synonyms
1H-Imidazo[4, 5-c]quinoline-1-ethanol, 4-amino-2-[(ethylamino)methyl]-alpha, alpha-dimethyl-, 2, 2, 2-trifluoroacetate (1:2) | 4Y6M4HJ0WU | 1H-IMIDAZO(4, 5-C)QUINOLINE-1-ETHANOL, 4-AMINO-2-((ETHYLAMINO)METHYL)-.ALPHA., .ALPHA.-DIMETHYL-, 2, 2, 2-TRIFLUOROACETATE
Specifications & Purity
≥99%
Biochemical and Physiological Mechanisms
Gardiquimod diTFA, an imidazoquinoline analog, is a TLR7/8 agonist. Gardiquimod diTFA could inhibit HIV-1 infection of macrophages and activated peripheral blood mononuclear cells (PBMCs). Gardiquimod diTFA specifically activates TLR7 when used at concent
Storage
Store at 2-8°C, Desiccated
Shipped In
Wet ice
This product requires cold chain shipping. Ground and other economy services are not available.
Action Type
INHIBITOR
Purity
≥99%
Names and Identifiers
Canonical SmilesCCNCC1=NC2=C(N1CC(C)(C)O)C3=CC=CC=C3N=C2N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
IUPAC Name1-[4-amino-2-(ethylaminomethyl)imidazo[4,5-c]quinolin-1-yl]-2-methylpropan-2-ol;2,2,2-trifluoroacetic acid
InChIKeyXFQPQSJDMJVOBN-UHFFFAOYSA-N
INCHI1S/C17H23N5O.2C2HF3O2/c1-4-19-9-13-21-14-15(22(13)10-17(2,3)23)11-7-5-6-8-12(11)20-16(14)18;2*3-2(4,5)1(6)7/h5-8,19,23H,4,9-10H2,1-3H3,(H2,18,20);2*(H,6,7)
Isomeric SMILES CCNCC1=NC2=C(N1CC(C)(C)O)C3=CC=CC=C3N=C2N.C(=O)(C(F)(F)F)O.C(=O)(C(F)(F)F)O
PubChem CID 44592365
Molecular Weight 541.4

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

KingdomOrganic compounds
SuperclassOrganoheterocyclic compounds
ClassQuinolines and derivatives
SubclassImidazoquinolines
Intermediate Tree Nodes Not available
Direct ParentImidazoquinolines
Alternative Parents Aminoquinolines and derivatives  Imidazo-[4,5-c]pyridines  Aminopyridines and derivatives  Aralkylamines  Benzenoids  N-substituted imidazoles  Imidolactams  Alpha-halocarboxylic acids  Tertiary alcohols  Heteroaromatic compounds  Dialkylamines  Carboxylic acids  Azacyclic compounds  Monocarboxylic acids and derivatives  Carbonyl compounds  Organic oxides  Organofluorides  Primary amines  Alkyl fluorides  Hydrocarbon derivatives  
Molecular FrameworkNot available
Substituents Imidazoquinoline - Aminoquinoline - Imidazopyridine - Imidazo-[4,5-c]pyridine - Aminopyridine - Aralkylamine - N-substituted imidazole - Pyridine - Imidolactam - Benzenoid - Alpha-halocarboxylic acid - Alpha-halocarboxylic acid or derivatives - Azole - Imidazole - Heteroaromatic compound - Tertiary alcohol - Azacycle - Secondary amine - Carboxylic acid derivative - Carboxylic acid - Monocarboxylic acid or derivatives - Secondary aliphatic amine - Organonitrogen compound - Alcohol - Organic oxide - Hydrocarbon derivative - Organohalogen compound - Carbonyl group - Alkyl halide - Organic oxygen compound - Organic nitrogen compound - Organooxygen compound - Primary amine - Alkyl fluoride - Organofluoride - Amine - Aromatic heteropolycyclic compound
DescriptionThis compound belongs to the class of organic compounds known as imidazoquinolines. These are aromatic heterocyclic compounds containing an imidazole ring fused to a quinoline ring system. In some configurations, the imidazole ring shares a nitrogen atom with the quinoline moiety.
External Descriptors Not available
3D Structure
Interactive Chemical Structure Model





Mechanisms of Action
Certificates(CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Chemical and Physical Properties
SolubilityDMSO : 50 mg/mL (92.35 mM; Need ultrasonic) H2O : 25 mg/mL (46.17 mM; Need ultrasonic)
Molecular Weight541.400 g/mol
XLogP3
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count15
Rotatable Bond Count5
Exact Mass541.176 Da
Monoisotopic Mass541.176 Da
Topological Polar Surface Area164.000 Ų
Heavy Atom Count37
Formal Charge0
Complexity488.000
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count3
Solution Calculators
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