MedKoo Cat#: 127985 | Name: Quetiapine Sulfoxide
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Description:

WARNING: This product is for research use only, not for human or veterinary use.

Quetiapine sulfoxide is an inactive metabolite of the atypical antipsychotic quetiapine.

Chemical Structure

Quetiapine Sulfoxide
Quetiapine Sulfoxide
CAS#329216-63-9

Theoretical Analysis

MedKoo Cat#: 127985

Name: Quetiapine Sulfoxide

CAS#: 329216-63-9

Chemical Formula: C21H25N3O3S

Exact Mass: 399.1617

Molecular Weight: 399.51

Elemental Analysis: C, 63.14; H, 6.31; N, 10.52; O, 12.01; S, 8.02

Price and Availability

Size Price Availability Quantity
1mg USD 350.00 2 Weeks
5mg USD 750.00 2 Weeks
10mg USD 1,250.00 2 Weeks
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Related CAS #
No Data
Synonym
Quetiapine Sulfoxide; Quetiapine;
IUPAC/Chemical Name
11-(4-(2-(2-hydroxyethoxy)ethyl)piperazin-1-yl)dibenzo[b,f][1,4]thiazepine 5-oxide
InChi Key
FXJNLPUSSHEDON-UHFFFAOYSA-N
InChi Code
InChI=1S/C21H25N3O3S/c25-14-16-27-15-13-23-9-11-24(12-10-23)21-17-5-1-3-7-19(17)28(26)20-8-4-2-6-18(20)22-21/h1-8,25H,9-16H2
SMILES Code
O=S1C2=C(N=C(N3CCN(CC3)CCOCCO)C4=C1C=CC=C4)C=CC=C2
Appearance
To be determined
Purity
>98% (or refer to the Certificate of Analysis)
Shipping Condition
Shipped under ambient temperature as non-hazardous chemical. This product is stable enough for a few weeks during ordinary shipping and time spent in Customs.
Storage Condition
Dry, dark and at 0 -4 C for short term (days to weeks) or -20 C for long term(months to years).
Solubility
To be determined
Shelf Life
>2 years if stored properly
Drug Formulation
To be determined
Stock Solution Storage
0 - 4 C for short term (days to weeks), or -20 C for long term (months).
HS Tariff Code
2934.99.9001
More Info

Preparing Stock Solutions

The following data is based on the product molecular weight 399.51 Batch specific molecular weights may vary from batch to batch due to the degree of hydration, which will affect the solvent volumes required to prepare stock solutions.

Recalculate based on batch purity %
Concentration / Solvent Volume / Mass 1 mg 5 mg 10 mg
1 mM 1.15 mL 5.76 mL 11.51 mL
5 mM 0.23 mL 1.15 mL 2.3 mL
10 mM 0.12 mL 0.58 mL 1.15 mL
50 mM 0.02 mL 0.12 mL 0.23 mL