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Chemical structure of HQ461

GC63854

HQ461

Also known as 2-[2-[(6-methyl-2-pyridinyl)amino]-1,3-thiazol-4-yl]-N-(5-methyl-1,3-thiazol-2-yl)acetamide

HQ461 is a molecular glue that promotes CDK12-DDB1 interaction to trigger cyclin K degradation· HQ461-mediated degradation of cyclin K impairs CDK12 function, resulting in decreased CDK12 substrate phosphorylation, downregulation of DNA damage response genes, and cell death

ChemicalCAS1226443-41-9MW345.44FormulaC15H15N5OS2
CAS number
1226443-41-9
Molecular weight
345.44
Formula
C15H15N5OS2
InChIKey
QMRBCNQCRMTXBE-UHFFFAOYSA-N
Catalogue number
GC63854
Brand
GLPBIO
Computed properties PubChem CID 49677967 · XLogP 3.1 · TPSA 136 Ų · H-bond donors 2
XLogP
3.1
TPSA
136 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
5
Heavy atoms
23

SMILES CC1=NC(=CC=C1)NC2=NC(=CS2)CC(=O)NC3=NC=C(S3)C

Computed descriptors from PubChem (CID 49677967), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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