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PLX51107

CAT: 0013-GTR19164493-02Size: 2 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19164493-02Size:2 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
PLX51107 is a potent, selective BET bromodomain inhibitor with low nanomolar affinity for BRD2, BRD3, BRD4, and BRDT. This small molecule is a valuable research tool for investigating BET protein function in oncology, immunology, and inflammation, supporting both in vitro biochemical assays and in vivo preclinical studies.
CAS Number
1627929-55-8
Product Name Alternative
BET, inhibit, PLX 51107, PLX51107, PLX-51107, Inhibitor, EpigeneticReaderDomain, Epigenetic Reader Domain
Field of Research
Epigenetics & Chromatin
Purity
99.75% (May vary between batches)
Solubility
DMSO:70 mg/mL (159.64 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (4.56 mM)
Smiles
C[C@@H] (c1ccccn1) n1cc (-c2ccc (cc2) C (O) =O) c2ncc (cc12) -c1c (C) noc1C
Molecular Formula
C26H22N4O3
Molecular Weight
438.48
Storage Conditions
Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.
Notes
For research use only.

Chemical Information

Plx-51107

PLX51107 is a potent and selective inhibitor of the bromodomain and extraterminal (BET) protein family. PLX51107 is under investigation in clinical trial NCT04022785 (PLX51107 and Azacitidine in Treating Patients With Acute Myeloid Leukemia or Myelodysplastic Syndrome).

CAS Number1627929-55-8
PubChem CID90448953
IUPAC Name4-[6-(3,5-dimethyl-1,2-oxazol-4-yl)-1-[(1S)-1-pyridin-2-ylethyl]pyrrolo[3,2-b]pyridin-3-yl]benzoic acid
Molecular FormulaC26H22N4O3
Molecular Weight438.5
XLogP4
Topological Polar Surface Area94
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Heavy Atom Count33
Formal Charge0
Complexity684
SMILES
CC1=C(C(=NO1)C)C2=CC3=C(C(=CN3[C@@H](C)C4=CC=CC=N4)C5=CC=C(C=C5)C(=O)O)N=C2
InChI
InChI=1S/C26H22N4O3/c1-15-24(17(3)33-29-15)20-12-23-25(28-13-20)21(18-7-9-19(10-8-18)26(31)32)14-30(23)16(2)22-6-4-5-11-27-22/h4-14,16H,1-3H3,(H,31,32)/t16-/m0/s1
InChIKey
AMSUHYUVOVCWTP-INIZCTEOSA-N
Chemical Structure
2D Structure
2D structure of Plx-51107
CAS: 1627929-55-8
CID: 90448953
Formula: C26H22N4O3
MW: 438.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight438.5
XLogP34
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count5
Exact Mass438.16919058
Monoisotopic Mass438.16919058
Topological Polar Surface Area94 Ų
Heavy Atom Count33
Formal Charge0
Complexity684
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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A18345-10PLX51107 10mg

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