Binifibrate
Basic information
- CAS
69047-39-8- Standard SMILES
CC(C)(Oc1ccc(Cl)cc1)C(=O)OC(COC(=O)c1cccnc1)COC(=O)c1cccnc1- InChIKey
BFYRHDVAEJIBON-UHFFFAOYSA-N- Molecular formula
- C25H23ClN2O7
- Average molar mass
- 498.9 g/mol
- Monoisotopic mass
- 498.1193788
Overview
Binifibrate is a monocarboxylic acid.
Names & identifiers
- Preferred name
- Binifibrate
- IUPAC
- [2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-3-(pyridine-3-carbonyloxy)propyl] pyridine-3-carboxylate
- English name
- Binifibrate
- Molecular formula
- C25H23ClN2O7
- Molecular weight
- 498.917
Names & synonyms
BinifibrateBiniwas69047-39-8BinifibratoBinifibratum9NGZ4GPE20DTXSID802191133-pyridine carboxylic acid 2-(2-(4-chlorophenoxy)-2-methyl-1-oxopropoxy)-1,3-propanediyl esterRefChem:119836DTXCID00141604Binifibrate [INN][2-[2-(4-chlorophenoxy)-2-methylpropanoyl]oxy-3-(pyridine-3-carbonyloxy)propyl] pyridine-3-carboxylate
Show more names
AntopalBis(3-pyridinecarboxylic acid)2-[2-(4-chlorophenoxy)-2-methyl-1-oxopropoxy]-1,3-propanediyl ester
Binifibrate (INN)2-(p-Chlorophenoxy)-2-methylpropionic acid ester with 1,3-dinicotininoyloxy-2-propanolBinifibratum [INN-Latin]Binifibrato [INN-Spanish]WAC 104UNII-9NGZ4GPE20Antopal retardWAC-104
Database identifiers
- CAS
69047-39-8- PubChem CID
- 68884
- DTXSID
DTXSID80219113- ChEMBL
CHEMBL2106582
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 114 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 13
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 678
Physicochemical properties
- Melting point
- 100 ° · 100°
- FDA UNII
- 9 NGZ4GPE20 · 9NGZ4GPE20
- Toxicity
- 50 orally · LD50 orally in mice and rats: >4000 mg/kg (Andreoli)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- Toxicity
- LD50 orally in mice and rats: >4000 mg/kg (Andreoli)
Chemistry & industry
Pharmacology
MeSH Pharmacological ClassificationSubstances that lower the levels of certain LIPIDS in the BLOOD. They are used to treat HYPERLIPIDEMIAS.
Applications
DescriptionBinifibrate is a triglyceridic, mutual prodrug of the hypolipidemics, nicotinic acid and clofibrate. In addition to its usefulness in the treatment of types II-IV hyperlipoproteinemias, it is reported to possess beneficial microhemorheological properties.
Additional notes
DefinitionChEBI: Binifibrate is a monocarboxylic acid.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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