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SGC-CAMKK2-1

CAT: 0931-T205037-01Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0931-T205037-01Size:10 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2561494-76-4
Target
Calmodulin, CaMK
Related Pathways
Membrane transporter/Ion channel, Neuroscience
Bioactivity
SGC-CAMKK2-1 is a selective inhibitor of calcium/calmodulin-dependent protein kinase kinase 2 (CAMKK2) with an IC50 of 30 nM. It effectively inhibits AMPK phosphorylation in C4-2 cells, exhibiting an IC50 value of 1.6 μM.
Smiles
O=C(O)C=1C=CC(=CC1C2CCCC2)C3=COC4=NC=C(C=C43)C=5C=CC=C(C5)C
Molecular Formula
C26H23NO3
Molecular Weight
397.466
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Sgc-camkk2-1

2-cyclopentyl-4-[5-(3-methylphenyl)furo[2,3-b]pyridin-3-yl]benzoic acid is a member of the class of furopyridines that is furo[2,3-b]pyridine substituted by a 4-carboxy-3-cyclopentylphenyl group at position 3 and by a 3-methylphenyl group at position 5. It is an inhibitor of CAMKK2 kinase (IC50 = 30nM). It has a role as an EC 2.7.11.17 (Ca(2+)/calmodulin-dependent protein kinase) inhibitor. It is a member of benzoic acids, a member of cyclopentanes, a monocarboxylic acid, a member of toluenes, a furopyridine and a biaryl.

CAS Number2561494-76-4
PubChem CID154700451
IUPAC Name2-cyclopentyl-4-[5-(3-methylphenyl)furo[2,3-b]pyridin-3-yl]benzoic acid
Molecular FormulaC26H23NO3
Molecular Weight397.5
XLogP6.7
Topological Polar Surface Area63.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count30
Formal Charge0
Complexity603
SMILES
CC1=CC(=CC=C1)C2=CC3=C(N=C2)OC=C3C4=CC(=C(C=C4)C(=O)O)C5CCCC5
InChI
InChI=1S/C26H23NO3/c1-16-5-4-8-18(11-16)20-13-23-24(15-30-25(23)27-14-20)19-9-10-21(26(28)29)22(12-19)17-6-2-3-7-17/h4-5,8-15,17H,2-3,6-7H2,1H3,(H,28,29)
InChIKey
TXIYVFVMXNFNRX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Sgc-camkk2-1
CAS: 2561494-76-4
CID: 154700451
Formula: C26H23NO3
MW: 397.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight397.5
XLogP36.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass397.16779360
Monoisotopic Mass397.16779360
Topological Polar Surface Area63.3 Ų
Heavy Atom Count30
Formal Charge0
Complexity603
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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