Imiglitazar

HCID 9890879

Basic information

CAS
250601-04-8
Standard SMILES
Cc1oc(-c2ccccc2)nc1COc1ccc(CO/N=C(\CCC(=O)O)c2ccccc2)cc1
InChIKey
ULVDFHLHKNJICZ-QCWLDUFUSA-N
Molecular formula
C28H26N2O5
Average molar mass
470.5 g/mol
Monoisotopic mass
470.18417193

Overview

Imiglitazar has been used in trials studying the treatment of Diabetes Mellitus.

Names & identifiers

Preferred name
Imiglitazar
IUPAC
(4E)-4-[[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methoxyimino]-4-phenylbutanoic acid
English name
Imiglitazar
Molecular formula
C28H26N2O5
Molecular weight
470.53

Names & synonyms

Imiglitazar250601-04-8TAK-559(4E)-4-[[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]phenyl]methoxyimino]-4-phenylbutanoic acidDTXSID008702807244710F59(4E)-4-[({4-[(5-METHYL-2-PHENYL-1,3-OXAZOL-4-YL)METHOXY]PHENYL}METHOXY)IMINO]-4-PHENYLBUTANOIC ACID(4E)-4-(((4-((5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy)phenyl)methoxy)imino)-4-phenylbutanoic acid(4E)-4-((4-((5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy)phenyl)methoxyimino)-4-phenylbutanoic acidIMIGLITAZARUMRefChem:148004DTXCID50910943
Show more names
Benzenebutanoic acid, γ-[[[4-[(5-methyl-2-phenyl-4-oxazolyl)methoxy]phenyl]methoxy]imino]-, (γE)-
Imiglitazar [INN]CHEMBL592054(E)-4-(((4-((5-Methyl-2-phenyloxazol-4-yl)methoxy)benzyl)oxy)imino)-4-phenylbutanoic acidTAK 559Benzenebutanoic acid, gamma-(((4-((5-methyl-2-phenyl-4-oxazolyl)methoxy)phenyl)methoxy)imino)-, (gammaE)-Benzenebutanoic acid, gamma-[[[4-[(5-methyl-2-phenyl-4-oxazolyl)methoxy]phenyl]methoxy]imino]-, (gammaE)-UNII-7244710F59SCHEMBL297183

Database identifiers

CAS
250601-04-8
PubChem CID
9890879
DTXSID
DTXSID00870280
ChEMBL
CHEMBL592054
UNII
7244710F59
Nikkaji
J1.852.412K

Properties

Computed structural properties

XLogP
5.1
Topological polar surface area
94.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
11
Heavy atoms
35

Experimental & physicochemical properties

DrugsPharmaceuticals -> Listed in ZINC15

Physicochemical properties

Boiling point
679.9 · 679.9±65.0 °C(Predicted)
Density
1.2 · 1.20±0.1 g/cm3(Predicted)
storage temp.
-20 °C · Store at -20°C
solubility
Soluble in DMSO
pka
4.17 · 4.17±0.10(Predicted)
FDA UNII
7244710 F59 · 7244710F59

Chemistry & industry

Applications

UsesImiglitazar (TAK559) is a potent and dual human PPARα and PPARγ1 agonist with EC50 values of 67 and 31 nM.

Suppliers7 total

北京博奥森生物技术有限公司400-901-9800 18611424007 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
范德(北京)生物科技有限责任公司15911056312 · [email protected]

Related reactions

18 records

Compound notes

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