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Chemical structure of JUN-1111

GC69323

JUN-1111

Also known as 7-(2-morpholin-4-ylethylamino)quinoline-5,8-dione

JUN-1111 is an irreversible selective inhibitor of Cdc25 phosphatase, with IC50 values of 0·38, 1·8, 0·66, 28 and 37 μM for Cdc25A, Cdc25B, Cdc25C, VHR and PTP1B respectively· JUN-1111 induces cell cycle arrest at G1 and G2/M phases and reduces the expression of phosphoCdk1

ChemicalCAS874351-38-9MW287.31FormulaC15H17N3O3
CAS number
874351-38-9
Molecular weight
287.31
Formula
C15H17N3O3
InChIKey
QWIRJCMQNFHGJV-UHFFFAOYSA-N
Catalogue number
GC69323
Brand
GLPBIO
Computed properties PubChem CID 11392050 · XLogP 0.6 · TPSA 71.5 Ų · H-bond donors 1
XLogP
0.6
TPSA
71.5 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
21

SMILES C1COCCN1CCNC2=CC(=O)C3=C(C2=O)N=CC=C3

Computed descriptors from PubChem (CID 11392050), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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