Products for Research Use Only

CAM4066

CAT: 0013-GTR19210097-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210097-03Size:100 mg
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Description
CAM4066 is a potent, selective inhibitor of the CK2α kinase. It is a valuable research tool for studying CK2's role in cancer and cellular signaling pathways in both in vitro and in vivo experimental models.
CAS Number
2101206-81-7
Smiles
ClC1=C (C=CC (CNCCC (NCCC (NC2=CC (C (O) =O) =CC=C2) =O) =O) =C1) C3=CC=CC=C3
Molecular Formula
C26H26ClN3O4
Molecular Weight
479.96
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-[(2-Chlorobiphenyl-4-Yl)methyl]-Beta-Alanyl-N-(3-Carboxyphenyl)-Beta-Alaninamide
CAS Number2101206-81-7
PubChem CID121232389
IUPAC Name3-[3-[3-[(3-chloro-4-phenylphenyl)methylamino]propanoylamino]propanoylamino]benzoic acid
Molecular FormulaC26H26ClN3O4
Molecular Weight480.0
XLogP0.8
Topological Polar Surface Area108
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Heavy Atom Count34
Formal Charge0
Complexity670
SMILES
C1=CC=C(C=C1)C2=C(C=C(C=C2)CNCCC(=O)NCCC(=O)NC3=CC=CC(=C3)C(=O)O)Cl
InChI
InChI=1S/C26H26ClN3O4/c27-23-15-18(9-10-22(23)19-5-2-1-3-6-19)17-28-13-11-24(31)29-14-12-25(32)30-21-8-4-7-20(16-21)26(33)34/h1-10,15-16,28H,11-14,17H2,(H,29,31)(H,30,32)(H,33,34)
InChIKey
NZDQDPKZQDWCOF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[(2-Chlorobiphenyl-4-Yl)methyl]-Beta-Alanyl-N-(3-Carboxyphenyl)-Beta-Alaninamide
CAS: 2101206-81-7
CID: 121232389
Formula: C26H26ClN3O4
MW: 480.0
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight480.0
XLogP30.8
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass479.1611840
Monoisotopic Mass479.1611840
Topological Polar Surface Area108 Ų
Heavy Atom Count34
Formal Charge0
Complexity670
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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