Products for Research Use Only

WP-1034

CAT: 0013-GTR19211432-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19211432-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
WP-1034 is a novel JAK-STAT inhibitor that suppresses proliferation and induces apoptosis in AML cell lines like OCIM2 and primary patient samples. It mediates these effects through cell cycle arrest, caspase-3 activation, and PARP cleavage, making it a candidate for hematological cancer research.
CAS Number
857064-42-7
Smiles
C (=C (/C (N[C@H] (C) C1=CC=CC=C1) =O) \C#N) \C2=CC=C (N (=O) =O) C=C2
Molecular Formula
C18H15N3O3
Molecular Weight
321.33
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

(E)-2-cyano-3-(4-nitrophenyl)-N-[(1R)-1-phenylethyl]prop-2-enamide
CAS Number857064-42-7
PubChem CID1525283
IUPAC Name(E)-2-cyano-3-(4-nitrophenyl)-N-[(1R)-1-phenylethyl]prop-2-enamide
Molecular FormulaC18H15N3O3
Molecular Weight321.3
XLogP3.3
Topological Polar Surface Area98.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity529
SMILES
C[C@H](C1=CC=CC=C1)NC(=O)/C(=C/C2=CC=C(C=C2)[N+](=O)[O-])/C#N
InChI
InChI=1S/C18H15N3O3/c1-13(15-5-3-2-4-6-15)20-18(22)16(12-19)11-14-7-9-17(10-8-14)21(23)24/h2-11,13H,1H3,(H,20,22)/b16-11+/t13-/m1/s1
InChIKey
RYYNDHCHTCVQJH-KWWJGWKXSA-N
Chemical Structure
2D Structure
2D structure of (E)-2-cyano-3-(4-nitrophenyl)-N-[(1R)-1-phenylethyl]prop-2-enamide
CAS: 857064-42-7
CID: 1525283
Formula: C18H15N3O3
MW: 321.3
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight321.3
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass321.11134135
Monoisotopic Mass321.11134135
Topological Polar Surface Area98.7 Ų
Heavy Atom Count24
Formal Charge0
Complexity529
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes