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GSK3a-IN-38

CAT: 0931-T77671-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T77671-01Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1062138-03-7
Target
GSK-3
Related Pathways
PI3K/Akt/mTOR signaling, Stem Cells
Purity
0.9975
Bioactivity
GSK3a-IN-38 is a novel small molecule compound that has inhibitory effects on GSK-3a.
Smiles
O=C1C2=C(NC=3NN=C(C3C2C=4C=CN=CC4)C)CC(C)(C)C1
Molecular Formula
C18H20N4O
Molecular Weight
308.38
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

3,7,7-trimethyl-4-(4-pyridinyl)-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
CAS Number1062138-03-7
PubChem CID3263182
IUPAC Name3,7,7-trimethyl-4-pyridin-4-yl-4,6,8,9-tetrahydro-2H-pyrazolo[3,4-b]quinolin-5-one
Molecular FormulaC18H20N4O
Molecular Weight308.4
XLogP2.4
Topological Polar Surface Area70.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity535
SMILES
CC1=C2C(C3=C(CC(CC3=O)(C)C)NC2=NN1)C4=CC=NC=C4
InChI
InChI=1S/C18H20N4O/c1-10-14-15(11-4-6-19-7-5-11)16-12(20-17(14)22-21-10)8-18(2,3)9-13(16)23/h4-7,15H,8-9H2,1-3H3,(H2,20,21,22)
InChIKey
PTZKYSSXHZXQEM-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3,7,7-trimethyl-4-(4-pyridinyl)-2,4,6,7,8,9-hexahydro-5H-pyrazolo[3,4-b]quinolin-5-one
CAS: 1062138-03-7
CID: 3263182
Formula: C18H20N4O
MW: 308.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight308.4
XLogP32.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count1
Exact Mass308.16371127
Monoisotopic Mass308.16371127
Topological Polar Surface Area70.7 Ų
Heavy Atom Count23
Formal Charge0
Complexity535
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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