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Chemical structure of PD 166285 dihydrochloride

GC50045

PD 166285 dihydrochloride

Also known as 6-(2,6-dichlorophenyl)-2-[4-[2-(diethylamino)ethoxy]anilino]-8-methylpyrido[2,3-d]pyrimidin-7-one;dihydrochloride

PD 166285 dihydrochloride, a substrate of P-gp, is a WEE1 inhibitor and a weak Myt1 inhibitor with IC50 values of 24 and 72 nM, respectively· PD 166285 dihydrochloride exhibits an IC50 of 3·433 μM for Chk1

ChemicalCAS212391-63-4MW585.35FormulaC26H27Cl2N5O2·2HCl
CAS number
212391-63-4
Molecular weight
585.35
Formula
C26H27Cl2N5O2·2HCl
Solubility
Soluble in DMSO
InChIKey
NADLBPWBFGTESN-UHFFFAOYSA-N
Catalogue number
GC50045
Brand
GLPBIO
Computed properties PubChem CID 9916391 · TPSA 70.6 Ų · H-bond donors 3 · H-bond acceptors 6
TPSA
70.6 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
9
Heavy atoms
37

SMILES CCN(CC)CCOC1=CC=C(C=C1)NC2=NC=C3C=C(C(=O)N(C3=N2)C)C4=C(C=CC=C4Cl)Cl.Cl.Cl

Computed descriptors from PubChem (CID 9916391), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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