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Chemical structure of AZD0022

GC26838

AZD0022

Also known as 4-[4-(3,8-diazabicyclo[3.2.1]oct-6-en-3-yl)-6,8-difluoro-2-[(2-fluoro-1,2,3,5,6,7-hexahydropyrrolizin-8-yl)methoxy]quinazolin-7-yl]-5-ethynyl-6-fluoronaphthalen-2-amine

AZD0022 is a selective and orally active KRAS G12D inhibitor that displays exposure-dependent pRSK inhibition in a GP2D xenograft model

ChemicalCAS2958627-18-2MW614.64FormulaC34H30F4N6O
CAS number
2958627-18-2
Molecular weight
614.64
Formula
C34H30F4N6O
InChIKey
HLFQZDAHMCQMND-UHFFFAOYSA-N
Catalogue number
GC26838
Brand
GLPBIO
Computed properties PubChem CID 176455489 · XLogP 5.6 · TPSA 79.5 Ų · H-bond donors 2
XLogP
5.6
TPSA
79.5 Ų
H-bond donors
2
H-bond acceptors
11
Rotatable bonds
6
Heavy atoms
45

SMILES C#CC1=C(C=CC2=CC(=CC(=C21)C3=C(C=C4C(=C3F)N=C(N=C4N5CC6C=CC(C5)N6)OCC78CCCN7CC(C8)F)F)N)F

Computed descriptors from PubChem (CID 176455489), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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