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Chemical structure of TMX-4116

GC64131

TMX-4116

Also known as 3-[4-[4-methoxy-5-(pyrrolidine-1-carbonyl)thiophen-3-yl]triazol-1-yl]piperidine-2,6-dione

TMX-4116 is a casein kinase 1α (CK1α) degrader· TMX-4116 shows the degradation preference for CK1α with DC50s less than 200 nM in MOLT4, Jurkat, and MM·1S cells· TMX-4116 can be used for the research of multiple myeloma

ChemicalCAS2766385-56-0MW389.43FormulaC17H19N5O4S
CAS number
2766385-56-0
Molecular weight
389.43
Formula
C17H19N5O4S
Solubility
DMSO：100mg/mL(256·79 mM; ultrasonic and warming and heat to 60°C)
InChIKey
OOIINFBRWZQRRM-UHFFFAOYSA-N
Catalogue number
GC64131
Brand
GLPBIO
Computed properties PubChem CID 162641722 · XLogP 0.6 · TPSA 135 Ų · H-bond donors 1
XLogP
0.6
TPSA
135 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
27

SMILES COC1=C(SC=C1C2=CN(N=N2)C3CCC(=O)NC3=O)C(=O)N4CCCC4

Computed descriptors from PubChem (CID 162641722), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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