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AZD2858

CAT: 0127-BUP07184-01Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP07184-01Size:1 mg
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CAS Number
486424-20-8
Purity
=95%
Smiles
C(NC=1C=CC=NC1)(=O)C=2N=C(C=NC2N)C3=CC=C(S(=O)(=O)N4CCN(C)CC4)C=C3

Chemical Information

Azd2858

AZD2858 is a member of the class of pyrazines that is pyrazine substituted by (pyridin-3-yl)aminocarbonyl, amino, and 4-(4-methylpiperazine-1-sulfonyl)phenyl groups at positions 2, 3 and 6, respectively. It is a potent inhibitor of GSK3alpha and GSK3beta (IC50 values of 0.9 and 4.9 nM, respectively) and increases bone mass (via Wnt activation) in rats. It has a role as a Wnt signalling activator, an antineoplastic agent, a bone density conservation agent and an EC 2.7.11.26 (tau-protein kinase) inhibitor. It is a secondary carboxamide, a member of pyridines, an aromatic amine, a sulfonamide, a member of pyrazines and a N-methylpiperazine.

CAS Number486424-20-8
PubChem CID10138980
IUPAC Name3-amino-6-[4-(4-methylpiperazin-1-yl)sulfonylphenyl]-N-pyridin-3-ylpyrazine-2-carboxamide
Molecular FormulaC21H23N7O3S
Molecular Weight453.5
XLogP0.7
Topological Polar Surface Area143
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count32
Formal Charge0
Complexity730
SMILES
CN1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=CN=C(C(=N3)C(=O)NC4=CN=CC=C4)N
InChI
InChI=1S/C21H23N7O3S/c1-27-9-11-28(12-10-27)32(30,31)17-6-4-15(5-7-17)18-14-24-20(22)19(26-18)21(29)25-16-3-2-8-23-13-16/h2-8,13-14H,9-12H2,1H3,(H2,22,24)(H,25,29)
InChIKey
FHCSBLWRGCOVPT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Azd2858
CAS: 486424-20-8
CID: 10138980
Formula: C21H23N7O3S
MW: 453.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight453.5
XLogP30.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass453.15830879
Monoisotopic Mass453.15830879
Topological Polar Surface Area143 Ų
Heavy Atom Count32
Formal Charge0
Complexity730
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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CatalogName
MBS3604627-01AZD2858
A13060-25AZD2858 25mg
A13060-2AZD2858 2mg
A13060-100AZD2858 100mg
A13060-500AZD2858 500mg
A13060-50AZD2858 50mg
A13060-10AZD2858 10mg
A13060-5AZD2858 5mg
A13060-1AZD2858 1mg
A13060-10mM-DAZD2858 10mM * 1mL in DMSO

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