CAS 1076199-40-0|Quetiapine N-oxide

Introduction：Basic information about CAS 1076199-40-0|Quetiapine N-oxide, including its chemical name, molecular formula, synonyms, physicochemical properties, and safety information, etc.
Common NameQuetiapine N-oxide
CAS Number1076199-40-0Molecular Weight399.50700
Density/Boiling Point/
Molecular FormulaC21H25N3O3SMelting Point/
MSDS/Flash Point/

Names

Name2-[2-(4-benzo[b][1,4]benzothiazepin-6-yl-1-oxidopiperazin-1-ium-1-yl)ethoxy]ethanol
SynonymMore Synonyms

Chemical & Physical Properties

Molecular FormulaC21H25N3O3S
Molecular Weight399.50700
Exact Mass399.16200
PSA99.79000
LogP2.20090
InChIKeyVVBXDYFGQNNTDS-UHFFFAOYSA-N
SMILES[O-][N+]1(CCOCCO)CCN(C2=Nc3ccccc3Sc3ccccc32)CC1
Storage condition-20℃

Synonyms

Quetiapine N-Oxide
Quetiapine Impurity 1
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