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Chemical structure of AZD4747

GC73533

AZD4747

Also known as 1-[(4aR)-8-(2-chloro-6-hydroxyphenyl)-7-fluoro-9-prop-1-ynyl-1,2,4,4a,5,11-hexahydropyrazino[2,1-c][1,4]benzoxazepin-3-yl]prop-2-en-1-one

AZD4747 is a selective, blood-brain barrier-permeable mutant GTPase KRASG12C inhibitor

ChemicalCAS2489226-14-2MW440.89FormulaC24H22ClFN2O3
CAS number
2489226-14-2
Molecular weight
440.89
Formula
C24H22ClFN2O3
Solubility
DMSO ： 250 mg/mL (567·03 mM; Need ultrasonic)
InChIKey
CNQOLVBNICGIJB-QGZVFWFLSA-N
Catalogue number
GC73533
Brand
GLPBIO
Computed properties PubChem CID 155684119 · XLogP 4.2 · TPSA 53 Ų · H-bond donors 1
XLogP
4.2
TPSA
53 Ų
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
31

SMILES CC#CC1=C(C(=C2C(=C1)CN3CCN(C[C@@H]3CO2)C(=O)C=C)F)C4=C(C=CC=C4Cl)O

Computed descriptors from PubChem (CID 155684119), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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