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IXA4

CAT: 1568-C14477-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1568-C14477-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1185329-96-7
SKU
C14477-5mg
Target
IRE1
Applications
ER stress & UPR
Smiles
CN (CCOC1=CC=C (C) C=C1) C (=O) C[N]2C=C (NC (=O) CCOC3=CC=CC=C3) C=N2
Molecular Formula
C24H28N4O4
Additionnal Information
IXA4, a highly selective, non-toxic IRE1/XBP1s activator, activates IRE1/XBP1s signaling without globally activating the unfolded protein response (UPR) or other stress-responsive signaling pathways, and reduces secretion of amyloid precursor protein (APP) through IRE1 activation, preventing APP-associated mitochondrial dysfunction.
Storage Conditions
3 years -20°C powder

Chemical Information

N-(1-((methyl(2-(4-methylphenoxy)ethyl)carbamoyl)methyl)-1H-pyrazol-4-yl)-3-phenoxypropanamide
CAS Number1185329-96-7
PubChem CID26357859
IUPAC NameN-[1-[2-[methyl-[2-(4-methylphenoxy)ethyl]amino]-2-oxoethyl]pyrazol-4-yl]-3-phenoxypropanamide
Molecular FormulaC24H28N4O4
Molecular Weight436.5
XLogP2.7
Topological Polar Surface Area85.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count32
Formal Charge0
Complexity576
SMILES
CC1=CC=C(C=C1)OCCN(C)C(=O)CN2C=C(C=N2)NC(=O)CCOC3=CC=CC=C3
InChI
InChI=1S/C24H28N4O4/c1-19-8-10-22(11-9-19)32-15-13-27(2)24(30)18-28-17-20(16-25-28)26-23(29)12-14-31-21-6-4-3-5-7-21/h3-11,16-17H,12-15,18H2,1-2H3,(H,26,29)
InChIKey
ZVSKMVAWWBSNOY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(1-((methyl(2-(4-methylphenoxy)ethyl)carbamoyl)methyl)-1H-pyrazol-4-yl)-3-phenoxypropanamide
CAS: 1185329-96-7
CID: 26357859
Formula: C24H28N4O4
MW: 436.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight436.5
XLogP32.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass436.21105539
Monoisotopic Mass436.21105539
Topological Polar Surface Area85.7 Ų
Heavy Atom Count32
Formal Charge0
Complexity576
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA4208-100IXA4

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