Products for Research Use Only
RegisterLogin

EN460

CAT: 1568-C01810-02Size: 25 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:1568-C01810-02Size:25 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
CAS Number
496807-64-8
SKU
C01810-5mg
Target
Others
Applications
Others
Additionnal Information
EN460 is a small-molecule inhibitor of endoplasmic reticulum oxidation 1 (ERO1), which is specific for the reduced active form of ERO1α and prevents re-oxidation. It also protects cells from erastin-induced ferroptosis.

Chemical Information

2-chloro-5-[(4Z)-5-oxo-4-[(5-phenylfuran-2-yl)methylidene]-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid

EN460 is an organic molecular entity. It has a role as an inhibitor.

CAS Number496807-64-8
PubChem CID1016023
IUPAC Name2-chloro-5-[(4Z)-5-oxo-4-[(5-phenylfuran-2-yl)methylidene]-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid
Molecular FormulaC22H12ClF3N2O4
Molecular Weight460.8
XLogP5.4
Topological Polar Surface Area83.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Heavy Atom Count32
Formal Charge0
Complexity809
SMILES
C1=CC=C(C=C1)C2=CC=C(O2)/C=C\3/C(=NN(C3=O)C4=CC(=C(C=C4)Cl)C(=O)O)C(F)(F)F
InChI
InChI=1S/C22H12ClF3N2O4/c23-17-8-6-13(10-15(17)21(30)31)28-20(29)16(19(27-28)22(24,25)26)11-14-7-9-18(32-14)12-4-2-1-3-5-12/h1-11H,(H,30,31)/b16-11-
InChIKey
RSLFQCNAOMQAIH-WJDWOHSUSA-N
Chemical Structure
2D Structure
2D structure of 2-chloro-5-[(4Z)-5-oxo-4-[(5-phenylfuran-2-yl)methylidene]-3-(trifluoromethyl)pyrazol-1-yl]benzoic acid
CAS: 496807-64-8
CID: 1016023
Formula: C22H12ClF3N2O4
MW: 460.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight460.8
XLogP35.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count4
Exact Mass460.0437690
Monoisotopic Mass460.0437690
Topological Polar Surface Area83.1 Ų
Heavy Atom Count32
Formal Charge0
Complexity809
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Related Products

CatalogName
C01743-25mgEN450
C01743-01EN450
C01743-5mgEN450

Alternative Products

CatalogName
448187-01EN460
217348ERO1 Inhibitor II, EN460
303254M/M042/EN460/RFL-390X590-1 AC Signs

Popular Products