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PI-1840

CAT: 0013-GTR19163313-02Size: 500 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19163313-02Size:500 mg
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Description
PI-1840 is a potent, selective, noncovalent, reversible inhibitor for proteasome chymotrypsin-like (CT-L) activity with IC50 of 27 nM, shows no effect on trypsin-like and peptidylglutamyl peptide hydrolyzing activities (IC50>100 uM) ; also displays 100-fold more selectivity for the constitutive proteasome over the immunoproteasome; induces the accumulation of proteasome substrates p27, Bax, and IκB-α, inhibits survival pathways and viability, and induces apoptosis in intact cancer cells, also sensitizes human cancer cells to the mdm2/p53 disruptor Nutlin; suppresses the growth in nude mice of human breast tumor xenografts.
CAS Number
1401223-22-0
Product Name Alternative
PI1840
Purity
>98% (HPLC)
Solubility
10 mM in DMSO
Smiles
CCCC1=CC=C (C=C1) OCC (=O) N (CC2=NC (=NO2) C3=CN=CC=C3) C (C) C
Molecular Formula
C22H26N4O3
Molecular Weight
394.4668
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
Acetamide, N- (1-methylethyl) -2- (4-propylphenoxy) -N-[[3- (3-pyridinyl) -1,2,4-oxadiazol-5-yl]methyl]-

Chemical Information

N-isopropyl-2-(4-propylphenoxy)-N-((3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl)methyl)acetamide
CAS Number1401223-22-0
PubChem CID56945245
IUPAC NameN-propan-2-yl-2-(4-propylphenoxy)-N-[(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)methyl]acetamide
Molecular FormulaC22H26N4O3
Molecular Weight394.5
XLogP3.9
Topological Polar Surface Area81.4
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Heavy Atom Count29
Formal Charge0
Complexity496
SMILES
CCCC1=CC=C(C=C1)OCC(=O)N(CC2=NC(=NO2)C3=CN=CC=C3)C(C)C
InChI
InChI=1S/C22H26N4O3/c1-4-6-17-8-10-19(11-9-17)28-15-21(27)26(16(2)3)14-20-24-22(25-29-20)18-7-5-12-23-13-18/h5,7-13,16H,4,6,14-15H2,1-3H3
InChIKey
ZVVXAODXPVWGMF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-isopropyl-2-(4-propylphenoxy)-N-((3-(pyridin-3-yl)-1,2,4-oxadiazol-5-yl)methyl)acetamide
CAS: 1401223-22-0
CID: 56945245
Formula: C22H26N4O3
MW: 394.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight394.5
XLogP33.9
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count6
Rotatable Bond Count9
Exact Mass394.20049070
Monoisotopic Mass394.20049070
Topological Polar Surface Area81.4 Ų
Heavy Atom Count29
Formal Charge0
Complexity496
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

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