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Product Overview

Product Code

TRC-H953225

CAS Number

139079-39-3

Product Format

Neat

Molecular Formula

C21 H25 N3 O3 S

Molecular Weight

399.51

API Family

Quetiapine

Product Categories

TRC, Antipsychotics, Antipsychotics, Agonist & antagonist analogues, Impurity Reference Materials , Antipsychotics, Dopamine receptors, Neurotransmission, Addiction, Alzheimer's, Depression, Huntington's, Parkinson's, Schizophrenia, Stress and Anxiety, Pain and Inflammation

Product Type

Impurity, Metabolite

Purity

>95% (HPLC)

Drug Type

Antipsychotics

Documentation

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Product Information

Chemical Data

Analyte Name

7-Hydroxyquetiapine

CAS Number

139079-39-3

Molecular Formula

C21 H25 N3 O3 S

Molecular Weight

399.51

Accurate Mass

399.1617

SMILES

OCCOCCN1CCN(CC1)C2=Nc3ccc(O)cc3Sc4ccccc24

InChI

InChI=1S/C21H25N3O3S/c25-12-14-27-13-11-23-7-9-24(10-8-23)21-17-3-1-2-4-19(17)28-20-15-16(26)5-6-18(20)22-21/h1-6,15,25-26H,7-14H2

IUPAC

6-[4-[2-(2-hydroxyethoxy)ethyl]piperazin-1-yl]benzo[b][1,4]benzothiazepin-2-ol

Product Data

Storage Temperature

-20°C

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Metabolite

Product Format

Neat

API Family

Quetiapine

Purity

>95% (HPLC)

Product Description

A metabolite of Quetiapine, a Benzothiazepine with mixed serotonin and dopamine receptor antagonistic properties used as an antipsychotic.

References: Newton, D., et al.: Drug Metab. Dispos., 23, 154

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