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GSK591

CAT: 0013-GTR19168019-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19168019-01Size:1 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
GSK591 (EPZ015866) is a potent and selective PRMT5 inhibitor with an IC50 of 11 nM. It is a valuable chemical probe for investigating PRMT5 biology in cancer research, demonstrating utility in both in vitro cellular assays and in vivo preclinical models of hematologic malignancies.
CAS Number
1616391-87-7
Product Name Alternative
HistoneMethyltransferase, Histone Methyltransferase, Inhibitor, GSK591, GSK-591, GSK 591, GSK 3203591, GSK3203591, GSK-3203591, EPZ015866, EPZ-015866, EPZ 015866, inhibit, PRMT5
Field of Research
Epigenetics & Chromatin
Purity
99.09% (May vary between batches)
Solubility
DMSO:60 mg/mL (157.7 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:2 mg/mL (5.26 mM)
Smiles
O[C@@H] (CNC (=O) c1ccnc (NC2CCC2) c1) CN1CCc2ccccc2C1
Molecular Formula
C22H28N4O2
Molecular Weight
380.48
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Gsk591

GSK591 (EPZ015866) is a potent and selective inhibitor of protein methyltransferase 5 (PRMT5).

CAS Number1616391-87-7
PubChem CID117072552
IUPAC Name2-(cyclobutylamino)-N-[(2S)-3-(3,4-dihydro-1H-isoquinolin-2-yl)-2-hydroxypropyl]pyridine-4-carboxamide
Molecular FormulaC22H28N4O2
Molecular Weight380.5
XLogP2.3
Topological Polar Surface Area77.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Heavy Atom Count28
Formal Charge0
Complexity513
SMILES
C1CC(C1)NC2=NC=CC(=C2)C(=O)NC[C@@H](CN3CCC4=CC=CC=C4C3)O
InChI
InChI=1S/C22H28N4O2/c27-20(15-26-11-9-16-4-1-2-5-18(16)14-26)13-24-22(28)17-8-10-23-21(12-17)25-19-6-3-7-19/h1-2,4-5,8,10,12,19-20,27H,3,6-7,9,11,13-15H2,(H,23,25)(H,24,28)/t20-/m0/s1
InChIKey
TWKYXZSXXXKKJU-FQEVSTJZSA-N
Chemical Structure
2D Structure
2D structure of Gsk591
CAS: 1616391-87-7
CID: 117072552
Formula: C22H28N4O2
MW: 380.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight380.5
XLogP32.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count7
Exact Mass380.22122615
Monoisotopic Mass380.22122615
Topological Polar Surface Area77.5 Ų
Heavy Atom Count28
Formal Charge0
Complexity513
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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