Determine the necessary mass, volume, or concentration for preparing a solution.
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| SKU | Size | Availability |
Price | Qty |
|---|---|---|---|---|
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F129495-5g
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5g |
1
|
$23.90
|
|
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F129495-25g
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25g |
1
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$81.90
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F129495-100g
|
100g |
1
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$294.90
|
|
Calcium-activated chloride channel blocker; NSAID. Also activates TRPC6
| Synonyms | MLS000028563 | 2-((3-Trifluromethyl)phenyl)aminobenzoic acid | BSPBio_002866 | CI 440 | CI-440 | DTXCID303063 | Prestwick_220 | FLUFENAMIC ACID [MI] | Acidum flufenamicum [INN-Latin] | BSPBio_000185 | CBiol_001756 | MFCD00002422 | TVX 916 | EINECS 208-494 |
|---|---|
| Specifications & Purity | Moligand™, ≥99% |
| Biochemical and Physiological Mechanisms | Nonsteroidal anti-inflammatory drug (NSAID). Inhibits calcium-activated chloride channels (CaCCs). Also increases currents through TRPC6 channels and inhibits currents through TRPC3 and TRPC7 channels. |
| Storage Temp | Protected from light,Room temperature |
| Shipped In | Normal |
| Grade | Moligand™ |
| Action Type | ACTIVATOR, AGONIST, CHANNEL BLOCKER, GATING INHIBITOR, INHIBITOR |
| Mechanism of action | Channel blocker of CaCC;Inhibitor of Cx23;Inhibitor of Cx25;Inhibitor of Cx26;Inhibitor of Cx30;Inhibitor of Cx30.2;Inhibitor of Cx30.3;Inhibitor of Cx31;Inhibitor of Cx31.1;Inhibitor of Cx31.9;Inhibitor of Cx32;Inhibitor of Cx36;Inhibitor of Cx37;Inhibit |
| Product Description |
Application: An NSAID found to be a reversible gap junction blocker |
Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Benzene and substituted derivatives |
| Subclass | Benzoic acids and derivatives |
| Intermediate Tree Nodes | Aminobenzoic acids and derivatives |
| Direct Parent | Aminobenzoic acids |
| Alternative Parents | Trifluoromethylbenzenes Benzoic acids Benzoyl derivatives Aniline and substituted anilines Vinylogous amides Amino acids Secondary amines Monocarboxylic acids and derivatives Carboxylic acids Organopnictogen compounds Organooxygen compounds Organofluorides Organic oxides Hydrocarbon derivatives Alkyl fluorides |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Aminobenzoic acid - Trifluoromethylbenzene - Benzoic acid - Benzoyl - Aniline or substituted anilines - Vinylogous amide - Amino acid or derivatives - Amino acid - Carboxylic acid derivative - Secondary amine - Carboxylic acid - Monocarboxylic acid or derivatives - Alkyl fluoride - Organofluoride - Organohalogen compound - Organonitrogen compound - Organooxygen compound - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Organic nitrogen compound - Amine - Alkyl halide - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as aminobenzoic acids. These are benzoic acids containing an amine group attached to the benzene moiety. |
| External Descriptors | organofluorine compound - aromatic amino acid |
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| Mechanism of Action | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | References |
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| Pubchem Sid | 488179762 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488179762 |
| IUPAC Name | 2-[3-(trifluoromethyl)anilino]benzoic acid |
| INCHI | InChI=1S/C14H10F3NO2/c15-14(16,17)9-4-3-5-10(8-9)18-12-7-2-1-6-11(12)13(19)20/h1-8,18H,(H,19,20) |
| InChIKey | LPEPZBJOKDYZAD-UHFFFAOYSA-N |
| Smiles | C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F |
| Isomeric SMILES | C1=CC=C(C(=C1)C(=O)O)NC2=CC=CC(=C2)C(F)(F)F |
| RTECS | CB4375000 |
| Molecular Weight | 281.23 |
| Beilstein | 14(3)905 |
| Reaxy-Rn | 1996069 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1996069&ln= |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
| Certificate of Analysis | Dec 13, 2024 | F129495 | |
| Certificate of Analysis | Dec 13, 2024 | F129495 | |
| Certificate of Analysis | Dec 13, 2024 | F129495 | |
| Certificate of Analysis | Dec 13, 2024 | F129495 | |
| Certificate of Analysis | Dec 13, 2024 | F129495 | |
| Certificate of Analysis | Jul 04, 2023 | F129495 | |
| Certificate of Analysis | Jul 04, 2023 | F129495 | |
| Certificate of Analysis | Jul 04, 2023 | F129495 | |
| Certificate of Analysis | Jul 04, 2023 | F129495 | |
| Certificate of Analysis | Jul 04, 2023 | F129495 | |
| Certificate of Analysis | Jul 04, 2023 | F129495 | |
| Certificate of Analysis | Feb 22, 2023 | F129495 |
| Solubility | Solvent:DMSO, Max Conc. mg/mL: 28.12, Max Conc. mM: 100; Solvent:ethanol, Max Conc. mg/mL: 28.12, Max Conc. mM: 100 |
|---|---|
| Sensitivity | Light sensitive |
| Melt Point(°C) | 133.0 to 137.0 °C |
| Molecular Weight | 281.230 g/mol |
| XLogP3 | 5.200 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 6 |
| Rotatable Bond Count | 3 |
| Exact Mass | 281.066 Da |
| Monoisotopic Mass | 281.066 Da |
| Topological Polar Surface Area | 49.300 Ų |
| Heavy Atom Count | 20 |
| Formal Charge | 0 |
| Complexity | 346.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
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