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MRT00033659

CAT: 0931-T16141-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T16141-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1401731-54-1
Target
Others, MDM-2/p53, Chk, Early 2 Factor (E2F), Casein Kinase
Related Pathways
Metabolism, Cell Cycle/Checkpoint, Apoptosis, Stem Cells, Others
Bioactivity
MRT00033659 is an effective broad-spectrum kinase inhibitor of CK1 (IC50=0.9 μM for CK1δ) and CHK1 (IC50=0.23 μM) . MRT00033659 is a pyrazolo-pyridine analogue. It also induces p53 pathway activation and E2F-1 destabilization.
Smiles
CC(=O)Nc1cccc(c1)-c1cnc2[nH]nc(C)c2c1
Molecular Formula
C15H14N4O
Molecular Weight
266.3
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(3-(3-methyl-1H-pyrazolo[3,4-b]pyridin-5-yl)phenyl)acetamide
CAS Number1401731-54-1
PubChem CID66555775
IUPAC NameN-[3-(3-methyl-2H-pyrazolo[3,4-b]pyridin-5-yl)phenyl]acetamide
Molecular FormulaC15H14N4O
Molecular Weight266.30
XLogP2
Topological Polar Surface Area70.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity362
SMILES
CC1=C2C=C(C=NC2=NN1)C3=CC(=CC=C3)NC(=O)C
InChI
InChI=1S/C15H14N4O/c1-9-14-7-12(8-16-15(14)19-18-9)11-4-3-5-13(6-11)17-10(2)20/h3-8H,1-2H3,(H,17,20)(H,16,18,19)
InChIKey
YFBPGSDPFRCNOY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(3-(3-methyl-1H-pyrazolo[3,4-b]pyridin-5-yl)phenyl)acetamide
CAS: 1401731-54-1
CID: 66555775
Formula: C15H14N4O
MW: 266.30
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight266.30
XLogP32
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass266.11676108
Monoisotopic Mass266.11676108
Topological Polar Surface Area70.7 Ų
Heavy Atom Count20
Formal Charge0
Complexity362
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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