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M5N36

CAT: 0013-GTR19212030-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19212030-02Size:50 mg
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Description
M5N36 is a potent and selective Cdc25C inhibitor with IC50 values of 0.06 μM (Cdc25C), 0.19 μM (Cdc25B), and 0.15 μM (Cdc25A) . Its anti-proliferative activity, linked to increased p-CDK1 and p-CDK2 levels, makes it a valuable chemical probe for cell cycle and oncology research in vitro.
CAS Number
2832887-40-6
Field of Research
Metabolism Research
Smiles
O=C1C=2C (C (=O) C (Cl) =C1NC (C) C3=CN (N=N3) C4=CC=C (CO) C=C4) =CC=CN2
Molecular Formula
C20H16ClN5O3
Molecular Weight
409.83
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

CID 166642624
CAS Number2832887-40-6
PubChem CID166642624
IUPAC Name6-chloro-7-[1-[1-[4-(hydroxymethyl)phenyl]triazol-4-yl]ethylamino]quinoline-5,8-dione
Molecular FormulaC20H16ClN5O3
Molecular Weight409.8
XLogP2.2
Topological Polar Surface Area110
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity679
SMILES
CC(C1=CN(N=N1)C2=CC=C(C=C2)CO)NC3=C(C(=O)C4=C(C3=O)N=CC=C4)Cl
InChI
InChI=1S/C20H16ClN5O3/c1-11(15-9-26(25-24-15)13-6-4-12(10-27)5-7-13)23-18-16(21)19(28)14-3-2-8-22-17(14)20(18)29/h2-9,11,23,27H,10H2,1H3
InChIKey
XSEYUBHGRYYOGZ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of CID 166642624
CAS: 2832887-40-6
CID: 166642624
Formula: C20H16ClN5O3
MW: 409.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight409.8
XLogP32.2
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass409.0941671
Monoisotopic Mass409.0941671
Topological Polar Surface Area110 Ų
Heavy Atom Count29
Formal Charge0
Complexity679
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
BA8144-10M5N36

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