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Halofenate

HCID 33584
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Basic information

CAS
24136-24-1
Standard SMILES
CC(=O)NCCOC(=O)C(Oc1cccc(C(F)(F)F)c1)c1ccc(Cl)cc1
InChIKey
BJBCSGQLZQGGIQ-UHFFFAOYSA-N
Molecular formula
C19H17ClF3NO4
Average molar mass
415.8 g/mol
Monoisotopic mass
415.0798202

Overview

Halofenate is a selective peroxisome proliferator-activated receptor gamma (PPAR-gamma) modulator with antilipidemic activity. Halofenate also decreases fasting plasma glucose in type 2 diabetic patients, but not normoglycemic subjects.

Names & identifiers

Preferred name
Halofenate
IUPAC
2-acetamidoethyl 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetate
English name
HALOFENATE
Molecular formula
C19H17ClF3NO4
Molecular weight
415.79

Names & synonyms

HALOFENATE26718-25-2MK 185HalofenatoMK-185HalofenatumK9TZK4MNO6DTXSID9023120Benzeneacetic acid, 4-chloro-alpha-(3-(trifluoromethyl)phenoxy)-, 2-(acetylamino)ethyl esterMK185RefChem:389032DTXCID103120
Show more names
Lipivas4-Chloro-α-[3-(trifluoromethyl)phenoxy]benzeneacetic acid 2-(acetylamino)ethyl esterBenzeneacetic acid, 4-chloro-α-[3-(trifluoromethyl)phenoxy]-, 2-(acetylamino)ethyl ester
Halofenate; Lipivas2-acetamidoethyl 2-(4-chlorophenyl)-2-[3-(trifluoromethyl)phenoxy]acetateCHEMBL456071Halofenatum [INN-Latin]Halofenato [INN-Spanish]UNII-K9TZK4MNO6Halofenate [USAN:INN:BAN]4-Chloro-alpha-[3-(trifluoromethyl)phenoxy]benzeneacetic acid 2-(acetylamino)ethyl ester

Database identifiers

CAS
24136-24-1、26718-25-2
PubChem CID
33584
DTXSID
DTXSID9023120
ChEMBL
CHEMBL456071
UNII
K9TZK4MNO6
Nikkaji
J10.438H

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
64.6 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
8
Heavy atoms
28
Formal charge
0
Complexity
524

Physicochemical properties

Boiling point
551.1 · 551.1±50.0 °C(Predicted)
Density
1.331 · 1.331±0.06 g/cm3(Predicted)
pka
15.32 · 15.32±0.46(Predicted)
FDA UNII
9 TZK4MNO6 · K9TZK4MNO6

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 2 items

Substances that lower the levels of certain LIPIDS in the BLOOD. They are used to treat HYPERLIPIDEMIAS.

Gout suppressants that act directly on the renal tubule to increase the excretion of uric acid, thus reducing its concentrations in plasma.

Applications

UsesAntihyperlipoproteinemic; uricosuric.

UsesHalofenate is a selective peroxisome proliferator-activated receptor γ (PPARγ) modulator with antidiabetic activity.

Related reactions

9 records
New reaction record
HRID 45984 reaction equation
HRID 45984As productuspto-grants-2013_09
HRID 448198 reaction equation
HRID 448198As productuspto-grants-2013_07
HRID 1166289 reaction equation
HRID 1166289As productuspto-grants-2003_09
HRID 1168465 reaction equation
HRID 1168465As productuspto-grants-2003_09
HRID 1224143 reaction equation
HRID 1224143As productTraining data from https://doi.org/10.1039/C8SC04228D (5/10)
HRID 1606596 reaction equation
HRID 1606596As productuspto-grants-1976_04
HRID 2064568 reaction equation
HRID 2064568As productuspto-grants-2012_10
HRID 2103784 reaction equation
HRID 2103784As productuspto-grants-2009_08
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Compound notes

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