Lifibrate
Basic information
- CAS
22204-91-7- Standard SMILES
CN1CCC(OC(=O)C(Oc2ccc(Cl)cc2)Oc2ccc(Cl)cc2)CC1- InChIKey
QDGIAPPCJRFVEK-UHFFFAOYSA-N- Molecular formula
- C20H21Cl2NO4
- Average molar mass
- 410.3 g/mol
- Monoisotopic mass
- 409.0847635
Overview
Lifibrate is a small molecule drug. The usage of the INN stem '-fibrate' in the name indicates that Lifibrate is a clofibrate derivative, peroxisome proliferator activated receptor-a (PPAR-a) agonist. Lifibrate has a monoisotopic molecular weight of 409.08 Da.
Names & identifiers
- Preferred name
- Lifibrate
- IUPAC
- (1-methylpiperidin-4-yl) 2,2-bis(4-chlorophenoxy)acetate
- English name
- lifibrate
- Molecular formula
- C20H21Cl2NO4
- Molecular weight
- 410.295
Names & synonyms
Lifibrate22204-91-7LifibratoLifibratumDTXSID1046217Acetic acid, bis(4-chlorophenoxy)-, 1-methyl-4-piperidinyl esterY4X961F8Z1DTXCID9026217RefChem:7991091-methyl-4-piperidyl bis(4-chlorophenoxy)acetate244-839-2MPCA
Show more names
42-348lifibrate USP/EP/BPQDGIAPPCJRFVEK-UHFFFAOYSA-N1-methyl-4-piperidinyl bis(4-chlorophenoxy)acetate1-Methyl-4-piperioinyl Bis-4-chlorophenoxy Acetate(1-methylpiperidin-4-yl)2,2-bis(4-chlorophenoxy)acetateBis(p-chlorophenoxy)acetic acid 1-methyl-4-piperidyl esterBis(4-chlorophenoxy)acetic acid 1-methyl-4-piperidyl ester
SaH-42-348(1-methylpiperidin-4-yl) 2,2-bis(4-chlorophenoxy)acetate1-Methyl-4-piperidyl bis(p-chlorophenoxy)acetate1-methylpiperidin-4-yl 2,2-bis(4-chlorophenoxy)acetate1-Methyl-4-piperidyl glyoxylate 2-(bis(p-chlorophenyl) acetal)NCGC00160542-01ACETIC ACID, BIS(p-CHLOROPHENOXY)-, 1-METHYL-4-PIPERIDYL ESTERLifibratum [INN-Latin]
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 7
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 433
Physicochemical properties
- Boiling point
- 538 · 538.0±50.0 °C(Predicted)
- Density
- 1.33 · 1.33±0.1 g/cm3(Predicted)
- pka
- 7.67 · 7.67±0.10(Predicted)
- FDA UNII
- 4 X961F8Z1 · Y4X961F8Z1
- Symbol(GHS)
- 6 · GHS06
- Signal word
- Danger
- Hazard statements
- 413 · H413-H301
- Precautionary statements
- 264 · P264-P270-P301+P310-P321-P330-P405-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P273, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Safety data
- Signal word
- Danger
- Symbol(GHS)
- GHS06
- Hazard statements
- H413-H301
- Precautionary statements
- P264-P270-P301+P310-P321-P330-P405-P501
Chemistry & industry
Applications
UsesAntihyperlipo proteinemic.
Related reactions
2 records
Compound notes
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