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Chemical structure of PTC-209

GC15725

PTC-209

Also known as N-(2,6-dibromo-4-methoxyphenyl)-4-(2-methylimidazo[1,2-a]pyrimidin-3-yl)-1,3-thiazol-2-amine

PTC-209, a low-molecular-weight compound that selectively inhibits BMI-1 with IC50 for 0·5µM in HT1080 cells, is a promising anticancer

ChemicalCAS315704-66-6MW495.19FormulaC17H13Br2N5OS
CAS number
315704-66-6
Molecular weight
495.19
Formula
C17H13Br2N5OS
Solubility
≥ 24·75mg/mL in DMSO
InChIKey
XVOOCQSWCCRVDY-UHFFFAOYSA-N
Catalogue number
GC15725
Brand
GLPBIO
Computed properties PubChem CID 1117196 · XLogP 5.5 · TPSA 92.6 Ų · H-bond donors 1
XLogP
5.5
TPSA
92.6 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
26

SMILES CC1=C(N2C=CC=NC2=N1)C3=CSC(=N3)NC4=C(C=C(C=C4Br)OC)Br

Computed descriptors from PubChem (CID 1117196), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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