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GDC-0084

CAT: 0013-GTR19163355-06Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19163355-06Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
A potent, selective, brain penetrant dual inhibitor of class I PI3Ks and mTOR with Ki of 2/46/3/10/70 nM for PI3Kα/β/δ/γ/mTOR, respectively; highly selective against a panel of 229 kinases (IC50>1 uM) ; shows antiproliferative (EC50 =0.3-1.1 uM) in 5 GBM cell lines; significantly and dose-dependently inhibits tumor growth in a subcutaneous U87 tumor xenograft model of glioblastoma in mice.Brain Cancer Phase 2 Discontinued.
CAS Number
1382979-44-3
Product Name Alternative
RG-7666
Purity
>98% (HPLC)
Solubility
DMSO: 6 mg/mL (Need ultrasonic)
Smiles
NC1=NC=C (C2=NC (N3CCOCC3) =C4N=C (C (C) (C) OCC5) N5C4=N2) C=N1
Molecular Formula
C18H22N8O2
Molecular Weight
382.4197
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.
Other Product Names
2-Pyrimidinamine, 5-[8,9-dihydro-6,6-dimethyl-4- (4-morpholinyl) -6H-[1,4]oxazino[4,3-e]purin-2-yl]-

Chemical Information

Paxalisib

GDC-0084 is under investigation in clinical trial NCT03696355 (Study of GDC-0084 in Pediatric Patients With Newly Diagnosed Diffuse Intrinsic Pontine Glioma or Diffuse Midline Gliomas).

CAS Number1382979-44-3
PubChem CID57384863
IUPAC Name5-(6,6-dimethyl-4-morpholin-4-yl-8,9-dihydropurino[8,9-c][1,4]oxazin-2-yl)pyrimidin-2-amine
Molecular FormulaC18H22N8O2
Molecular Weight382.4
XLogP-0.3
Topological Polar Surface Area117
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Heavy Atom Count28
Formal Charge0
Complexity552
SMILES
CC1(C2=NC3=C(N2CCO1)N=C(N=C3N4CCOCC4)C5=CN=C(N=C5)N)C
InChI
InChI=1S/C18H22N8O2/c1-18(2)16-22-12-14(25-3-6-27-7-4-25)23-13(11-9-20-17(19)21-10-11)24-15(12)26(16)5-8-28-18/h9-10H,3-8H2,1-2H3,(H2,19,20,21)
InChIKey
LGWACEZVCMBSKW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Paxalisib
CAS: 1382979-44-3
CID: 57384863
Formula: C18H22N8O2
MW: 382.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight382.4
XLogP3-0.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count2
Exact Mass382.18657197
Monoisotopic Mass382.18657197
Topological Polar Surface Area117 Ų
Heavy Atom Count28
Formal Charge0
Complexity552
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
B7826-1GDC-0084
FD145121-01GDC 0084
C13229-10mM/1mLPaxalisib (GDC-0084)
451114-01GDC 0084 discontinued
MBS131429GDC-0084 (GDC0084; GDC 0084; RG7666; RG-7666; RG 7666)
A16272-25Paxalisib (GDC-0084) 25mg
A16272-5Paxalisib (GDC-0084) 5mg

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