Products for Research Use Only

BX517

CAT: 0013-GTR19169994-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19169994-04Size:10 mg
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Description
BX517 is a potent and selective small molecule inhibitor targeting PDK1. It is a valuable research tool for studying PI3K/AKT signaling pathways in cancer biology, applicable in both cellular and biochemical in vitro assays.
CAS Number
850717-64-5
Product Name Alternative
Akt2, BX517, BX-517, BX 517, inhibit, Inhibitor, PDK-1, PDK1, PDK1 inhibitor 2
Field of Research
Signal Transduction
Purity
98.00% (May vary between batches)
Solubility
10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (7.08 mM) ; DMSO:50 mg/mL (177.12 mM)
Smiles
C\C (=C1\C (=O) Nc2ccc (NC (N) =O) cc12) c1ccc[nH]1
Molecular Formula
C15H14N4O2
Molecular Weight
282.3
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

BX-517

a phosphoinositide-dependent kinase-1 inhibitor; structure in first source

CAS Number850717-64-5
PubChem CID11161844
IUPAC Name[(3Z)-2-oxo-3-[1-(1H-pyrrol-2-yl)ethylidene]-1H-indol-5-yl]urea
Molecular FormulaC15H14N4O2
Molecular Weight282.30
XLogP0.9
Topological Polar Surface Area100
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity488
SMILES
C/C(=C/1\C2=C(C=CC(=C2)NC(=O)N)NC1=O)/C3=CC=CN3
InChI
InChI=1S/C15H14N4O2/c1-8(11-3-2-6-17-11)13-10-7-9(18-15(16)21)4-5-12(10)19-14(13)20/h2-7,17H,1H3,(H,19,20)(H3,16,18,21)/b13-8-
InChIKey
DFURSNCTQGJRRX-JYRVWZFOSA-N
Chemical Structure
2D Structure
2D structure of BX-517
CAS: 850717-64-5
CID: 11161844
Formula: C15H14N4O2
MW: 282.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight282.30
XLogP30.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count2
Rotatable Bond Count2
Exact Mass282.11167570
Monoisotopic Mass282.11167570
Topological Polar Surface Area100 Ų
Heavy Atom Count21
Formal Charge0
Complexity488
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

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