| Chemical & Physical Properties | |
|---|---|
| CAS Number | 23642-66-2 |
| Catalog No. | 2A-1168689 |
| Chinese Name | 盐酸苯氟雷司 |
| Synonyms | N-(1-methyl-2-(3-[trifluoromethyl]-phenyl)ethyl]aminoethanol benzoate |
| Molecular Formula | C19H21ClF3NO2 |
| Molecular Weight | 387.82400 |
| Density | 1.183g/cm3 |
| Boiling Point | 420.5ºC at 760mmHg |
| Melting Point | 158-159?C |
| Storage Condition | Refrigerator |
| Application | Benfluorex hydrochloride (JP-992 hydrochloride) is a hepatic nuclear factor 4α (HNF4α) activator. |
| PubChem ID | 3219664 |
| SMILES | CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccccc1.Cl |
| InChI | InChI=1S/C19H20F3NO2.ClH/c1-14(12-15-6-5-9-17(13-15)19(20,21)22)23-10-11-25-18(24)16-7-3-2-4-8-16;/h2-9,13-14,23H,10-12H2,1H3;1H |
| InChI Key | NLOALSPYZIIXEO-UHFFFAOYSA-N |
| Hazard Symbols | transportation |
| Bioactivity | Benfluorex hydrochloride (JP-992 hydrochloride) is a hepatic nuclear factor 4 alpha (HNF4α) activator. Related Catalog Research Areas >> Cardiovascular Disease Signaling Pathways >> Others >> Others Research Areas >> Metabolic Disease Target HNF4α[1] In Vitro Benfluorex hydrochloride consistently activates insulin promoter activity as measured by an increased number of GFP-positive cells. Benfluorex hydrochloride increases the number of GFP-positive cells in a dose-responsive manner and increases the level of endogenous insulin mRNA. Consistent with being HNF4α activator, Benfluorex hydrochloride stimulates HNF4α expression. Benfluorex hydrochloride alters HNF4α protease sensitivity, while the inactive control compound does not[1]. Benfluorex hydrochloride decreases, in a concentration-dependent manner, the synthesis of acid-soluble products and ketone bodies from oleate, whereas the production of 14CO2 into citric acid cycle is markedly increased by Benfluorex hydrochloride. Benfluorex hydrochloride inhibits in a dose-dependent manner the rates of gluconeogenesis from lactate/pyruvate (10/1 nM)[2]. Kinase Assay HepG2 cells are treated with DMSO or Benfluorex hydrochloride at a concentration of 20 µM or 40 µM for 16 hr.Total cell protein is extracted, measured by BCA protein assay. Each sample is split into two aliquots for proteolysis without (-) or with (+) Subtilisin. Twenty ug of cell lysate is incubated with or without protease (20 ng/mL subtilisin) for 35 minutes at room temperature. Western blot is then performed with primary anti-HNF4α polyclonal antibody (1:1000 dilution) and secondary HRP conjugated anti-goat IgG (1:2000 dilution), detected with chemiluminescence ECL kit[1]. Cell Assay Hepatocytes are isolated by in situ perfusion of the liver with 0.025% collagenase. Hepatocytes (1 to 2×106 cells/mL) are incubated at 37°C in 2 mL of oxygenated (O2:CO2; 95:5) Krebs-Henseleit bicarbonate buffer (pH 7.4) for 1 h in a gyratory shaking water bath. Benfluorex hydrochloride is dissolved in DMSO and added (10 μL) to the incubation medium at a final concentration of 0.1 or 1 nM[2]. References [1]. Lee SH, et al. Identification of alverine and benfluorex as HNF4α activators. ACS Chem Biol. 2013 Aug 16;8(8):1730-6. [2]. Kohl C, et al. Effects of benfluorex on fatty acid and glucose metabolism in isolated rat hepatocytes: from metabolic fluxes to gene expression. Diabetes. 2002 Aug;51(8):2363-8. Chemical & Physical Properties Density 1.183g/cm3 Boiling Point 420.5ºC at 760mmHg Melting Point 158-159?C Molecular Formula C19H21ClF3NO2 Molecular Weight 387.82400 Flash Point 208.1ºC Exact Mass 387.12100 PSA 38.33000 LogP 5.27590 Vapour Pressure 2.81E-07mmHg at 25°C InChIKey NLOALSPYZIIXEO-UHFFFAOYSA-N SMILES CC(Cc1cccc(C(F)(F)F)c1)NCCOC(=O)c1ccccc1.Cl Storage condition Refrigerator |
| Use of | Benfluorex hydrochloride (JP-992 hydrochloride) is a hepatic nuclear factor 4 alpha (HNF4α) activator. Properties Articles26 Name benfluorex hydrochloride Benfluorex hydrochloride Biological Activity Description Benfluorex hydrochloride (JP-992 hydrochloride) is a hepatic nuclear factor 4 alpha (HNF4α) activator. Related Catalog Research Areas >> Cardiovascular Disease Signaling Pathways >> Others >> Others Research Areas >> Metabolic Disease References [1]. Lee SH, et al. Identification of alverine and benfluorex as HNF4α activators. ACS Chem Biol. 2013 Aug 16;8(8):1730-6. [2]. Kohl C, et al. Effects of benfluorex on fatty acid and glucose metabolism in isolated rat hepatocytes: from metabolic fluxes to gene expression. Diabetes. 2002 Aug;51(8):2363-8. Chemical & Physical Properties Exact Mass 387.12100 PSA 38.33000 LogP 5.27590 InChIKey NLOALSPYZIIXEO-UHFFFAOYSA-N Storage condition Refrigerator |
| Transport Info | Product name: Purity: 98.0% |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 Names specified by the United Nations (UN) European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Dangerous Regulations: No International Maritime Transport Dangerous Regulations Maritime Pollutants: No International Air Transport Risk Regulations: No 14.6 Special reminder to users No data available |
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