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Chemical structure of Gefitinib impurity 5

GC75171

Gefitinib impurity 5

Also known as 7-methoxy-6-(3-morpholin-4-ylpropoxy)-3H-quinazolin-4-one

Gefitinib impurity 5 is the impurity of Gefitinib

ChemicalCAS199327-61-2MW319.36FormulaC16H21N3O4
CAS number
199327-61-2
Molecular weight
319.36
Formula
C16H21N3O4
Solubility
DMSO： 2 mg/mL (6·26 mM; ultrasonic and warming and heat to 60°C)
InChIKey
WFUBWLXSYCFZEH-UHFFFAOYSA-N
Catalogue number
GC75171
Brand
GLPBIO
Computed properties PubChem CID 135399673 · XLogP 0.7 · TPSA 72.4 Ų · H-bond donors 1
XLogP
0.7
TPSA
72.4 Ų
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
23

SMILES COC1=C(C=C2C(=C1)N=CNC2=O)OCCCN3CCOCC3

Computed descriptors from PubChem (CID 135399673), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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