Products for Research Use Only

CAN508

CAT: 0013-GTR19165858-01Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19165858-01Size:5 mg
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Description
CAN508 is a potent and selective ATP-competitive inhibitor of CDK9/cyclin T1 (IC50=0.35 μM), showing 38-fold selectivity over other CDKs like CDK2/cyclin E. Its mechanism supports its investigation as a potential antitumor agent in cancer research, applicable for both in vitro biochemical assays and cellular studies.
CAS Number
140651-18-9
Product Name Alternative
ATP-competitive, CAN 508, CAN508, CAN-508, adenocarcinoma, Cyclin dependent kinase, cells, CDK9/cyclin T1, CDK, inhibit, Inhibitor, HT-29, esophageal
Field of Research
Cell Biology
Purity
98.65% (May vary between batches)
Solubility
DMSO:250 mg/mL (1145.63 mM) ;10% DMSO+40% PEG300+5% Tween 80+45% Saline:5 mg/mL (22.91 mM)
Smiles
Nc1n[nH]c (N) c1\N=N\c1ccc (O) cc1
Molecular Formula
C9H10N6O
Molecular Weight
218.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

4-[(E)-(3,5-Diamino-1h-Pyrazol-4-Yl)diazenyl]phenol

CAN-508 is a member of the class of pyrazoles that is 1H-pyrazole substituted by amino, (4-hydroxyphenyl)diazenyl, and amino groups at positions 3, 4 and 5, respectively. It is a CDK9 inhibitor (IC50 = 0.35 M) with 38-fold selectivity for CDK9/cyclin T over other CDK/cyclin complexes. It has a role as an antineoplastic agent, an angiogenesis inhibitor, an apoptosis inducer and an EC 2.7.11.22 (cyclin-dependent kinase) inhibitor. It is a member of pyrazoles, a member of phenols, an aromatic amine and a monoazo compound.

CAS Number140651-18-9
PubChem CID135398514
IUPAC Name4-[(3,5-diamino-1H-pyrazol-4-yl)diazenyl]phenol
Molecular FormulaC9H10N6O
Molecular Weight218.22
XLogP0.9
Topological Polar Surface Area126
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Heavy Atom Count16
Formal Charge0
Complexity252
SMILES
C1=CC(=CC=C1N=NC2=C(NN=C2N)N)O
InChI
InChI=1S/C9H10N6O/c10-8-7(9(11)15-14-8)13-12-5-1-3-6(16)4-2-5/h1-4,16H,(H5,10,11,14,15)
InChIKey
AYZRKFOEZQBUEA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-[(E)-(3,5-Diamino-1h-Pyrazol-4-Yl)diazenyl]phenol
CAS: 140651-18-9
CID: 135398514
Formula: C9H10N6O
MW: 218.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight218.22
XLogP30.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count6
Rotatable Bond Count2
Exact Mass218.09160896
Monoisotopic Mass218.09160896
Topological Polar Surface Area126 Ų
Heavy Atom Count16
Formal Charge0
Complexity252
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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