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GNF4877

CAT: 0931-T11447-05Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T11447-05Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2041073-22-5
Target
DYRK, GSK-3
Related Pathways
Tyrosine Kinase/Adaptors, Stem Cells, PI3K/Akt/mTOR signaling, Cell Cycle/Checkpoint
Purity
0.994
Bioactivity
GNF4877 is a potent inhibitor of DYRK1A and GSK3β (IC50s: 6 nM and 16 nM, respectively), resulting in the blockade of nuclear export of nuclear factor of activated T-cells (NFATc) and increased β-cell proliferation.
Smiles
CC(C)Oc1ccc(F)c(c1)-c1cnc(N)c(n1)C(=O)Nc1cnccc1N1CCC[C@H](C1)C(O)=O
Molecular Formula
C25H27FN6O4
Molecular Weight
494.52
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

(R)-1-(3-(3-Amino-6-(2-fluoro-5-isopropoxyphenyl)pyrazine-2-carboxamido)pyridin-4-yl)piperidine-3-carboxylic acid
CAS Number2041073-22-5
PubChem CID139600315
IUPAC Name(3R)-1-[3-[[3-amino-6-(2-fluoro-5-propan-2-yloxyphenyl)pyrazine-2-carbonyl]amino]-4-pyridinyl]piperidine-3-carboxylic acid
Molecular FormulaC25H27FN6O4
Molecular Weight494.5
XLogP2.8
Topological Polar Surface Area144
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count7
Heavy Atom Count36
Formal Charge0
Complexity760
SMILES
CC(C)OC1=CC(=C(C=C1)F)C2=CN=C(C(=N2)C(=O)NC3=C(C=CN=C3)N4CCC[C@H](C4)C(=O)O)N
InChI
InChI=1S/C25H27FN6O4/c1-14(2)36-16-5-6-18(26)17(10-16)19-12-29-23(27)22(30-19)24(33)31-20-11-28-8-7-21(20)32-9-3-4-15(13-32)25(34)35/h5-8,10-12,14-15H,3-4,9,13H2,1-2H3,(H2,27,29)(H,31,33)(H,34,35)/t15-/m1/s1
InChIKey
UZIATSFXNVOVFE-OAHLLOKOSA-N
Chemical Structure
2D Structure
2D structure of (R)-1-(3-(3-Amino-6-(2-fluoro-5-isopropoxyphenyl)pyrazine-2-carboxamido)pyridin-4-yl)piperidine-3-carboxylic acid
CAS: 2041073-22-5
CID: 139600315
Formula: C25H27FN6O4
MW: 494.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight494.5
XLogP32.8
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count10
Rotatable Bond Count7
Exact Mass494.20778153
Monoisotopic Mass494.20778153
Topological Polar Surface Area144 Ų
Heavy Atom Count36
Formal Charge0
Complexity760
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

CatalogName
MBS133129GNF4877
bs-60294C-01GNF4877 --- β Cell Proliferation Inducer

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