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PK11007

CAT: 1568-C01836-02Size: 25 mgDry Ice: NoHazardous: No
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CAT#:1568-C01836-02Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
874146-69-7
SKU
C01836-5mg
Target
P53
Applications
Apoptosis
Additionnal Information
PK11007 is a thiol-reactive anticancer agent that stabilizes p53 via selective alkylation of two surface cysteines without compromising its DNA binding. It induces mutant p53 cancer cell death by increasing reactive oxygen species (ROS) levels.

Chemical Information

5-Chloro-2-((4-fluorobenzyl)sulfonyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
CAS Number874146-69-7
PubChem CID16446482
IUPAC Name5-chloro-2-[(4-fluorophenyl)methylsulfonyl]-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
Molecular FormulaC15H11ClFN5O3S2
Molecular Weight427.9
XLogP2.3
Topological Polar Surface Area151
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Heavy Atom Count27
Formal Charge0
Complexity629
SMILES
CC1=NN=C(S1)NC(=O)C2=NC(=NC=C2Cl)S(=O)(=O)CC3=CC=C(C=C3)F
InChI
InChI=1S/C15H11ClFN5O3S2/c1-8-21-22-14(26-8)20-13(23)12-11(16)6-18-15(19-12)27(24,25)7-9-2-4-10(17)5-3-9/h2-6H,7H2,1H3,(H,20,22,23)
InChIKey
IVZQUWCWXYFPOQ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-Chloro-2-((4-fluorobenzyl)sulfonyl)-N-(5-methyl-1,3,4-thiadiazol-2-yl)pyrimidine-4-carboxamide
CAS: 874146-69-7
CID: 16446482
Formula: C15H11ClFN5O3S2
MW: 427.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight427.9
XLogP32.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count9
Rotatable Bond Count5
Exact Mass426.9975874
Monoisotopic Mass426.9975874
Topological Polar Surface Area151 Ų
Heavy Atom Count27
Formal Charge0
Complexity629
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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Alternative Products

CatalogName
HY-128784-01PK11007
A16833-50PK11007 50mg
A16833-10PK11007 10mg
A16833-5PK11007 5mg
A16833-25PK11007 25mg
A16833-100PK11007 100mg
A16833-10mM-DPK11007 10mM * 1mL in DMSO
TBI4176-25MGPK11007, Reactivator of mutant p53

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