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XL019

CAT: 0013-GTR19160683-07Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19160683-07Size:50 mg
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Description
XL019 is a potent and selective JAK2 inhibitor with IC50 of 2.2 nM, exhibiting >50-fold selectivity over JAK1, JAK3 and TYK2. Phase 1. (In Vivo) :XL019 (100-300 mg/kg; p.o.; twice daily for 14 days) inhibits HEL.92.1.7 xenograft tumor growth.XL019 (10 mg/kg) treatment shows that the Cmax, t1/2 and Vd were 5.24 μM, 1.94 hours, 5.319 L/kg, respectively.
CAS Number
945755-56-6
Product Name Alternative
XL019 | XL-019 | XL 019
Purity
>98% (HPLC)
Solubility
DMSO: 16 mg/mL (35.99 mM)
Smiles
O=C ([C@H]1NCCC1) NC2=CC=C (C3=NC (NC4=CC=C (N5CCOCC5) C=C4) =NC=C3) C=C2
Molecular Formula
C25H28N6O2
Molecular Weight
444.53
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
(S) -N- (4- (2- ((4-morpholinophenyl) amino) pyrimidin-4-yl) phenyl) pyrrolidine-2-carboxamide

Chemical Information

XL019

XL019 is a selective inhibitor of the cytoplasmic tyrosine kinase JAK2. An IND for XL019 was filed by Exelixis in May 2007.

CAS Number945755-56-6
PubChem CID57990869
IUPAC Name(2S)-N-[4-[2-(4-morpholin-4-ylanilino)pyrimidin-4-yl]phenyl]pyrrolidine-2-carboxamide
Molecular FormulaC25H28N6O2
Molecular Weight444.5
XLogP2.8
Topological Polar Surface Area91.4
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Heavy Atom Count33
Formal Charge0
Complexity614
SMILES
C1C[C@H](NC1)C(=O)NC2=CC=C(C=C2)C3=NC(=NC=C3)NC4=CC=C(C=C4)N5CCOCC5
InChI
InChI=1S/C25H28N6O2/c32-24(23-2-1-12-26-23)28-19-5-3-18(4-6-19)22-11-13-27-25(30-22)29-20-7-9-21(10-8-20)31-14-16-33-17-15-31/h3-11,13,23,26H,1-2,12,14-17H2,(H,28,32)(H,27,29,30)/t23-/m0/s1
InChIKey
ISOCDPQFIXDIMS-QHCPKHFHSA-N
Chemical Structure
2D Structure
2D structure of XL019
CAS: 945755-56-6
CID: 57990869
Formula: C25H28N6O2
MW: 444.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight444.5
XLogP32.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count6
Exact Mass444.22737416
Monoisotopic Mass444.22737416
Topological Polar Surface Area91.4 Ų
Heavy Atom Count33
Formal Charge0
Complexity614
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

Alternative Products

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SD4753-10mMXL019 (JAK inhibitor)

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