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MedKoo Cat#: 413905 | Name: Dothiepin sulfoxide

Description:

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

Dothiepin sulfoxide is a tricyclic antidepressant (TCA) which is used in the treatment of depression.

Chemical Structure

Dothiepin sulfoxide
Dothiepin sulfoxide
CAS#42046-35-5 (sulfoxide)

Theoretical Analysis

MedKoo Cat#: 413905

Name: Dothiepin sulfoxide

CAS#: 42046-35-5 (sulfoxide)

Chemical Formula: C19H21NOS

Exact Mass: 311.1344

Molecular Weight: 311.44

Elemental Analysis: C, 73.27; H, 6.80; N, 4.50; O, 5.14; S, 10.29

Price and Availability

This product is currently not in stock but may be available through custom synthesis. To ensure cost efficiency, the minimum order quantity is 1 gram. The estimated lead time is 2 to 4 months, with pricing dependent on the complexity of the synthesis (typically high for intricate chemistries). Quotes for quantities below 1 gram will not be provided. To request a quote, please click the button below. Note: If this product becomes available in stock in the future, pricing will be listed accordingly.
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Related CAS #
42046-35-5 (sulfoxide) 25627-36-5 (HCl)
Synonym
Dothiepin sulfoxide
IUPAC/Chemical Name
1-Propanamine, N,N-dimethyl-3-(5-oxidodibenzo(b,E)thiepin-11(6H)-ylidene)-, (E)-
InChi Key
NBNPVRZHUPMVQS-GZTJUZNOSA-N
InChi Code
NBNPVRZHUPMVQS-GZTJUZNOSA-N
SMILES Code
O=S1C2=CC=CC=C2/C(C3=CC=CC=C3C1)=C/CCN(C)C
Appearance
Solid powder
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 311.44 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
1: Fulton A, Norman TR, Cheng H, Burrows GD. Assessment of the antidepressant activity of dothiepin and its metabolites by preclinical tests. J Affect Disord. 1982 Sep;4(3):261-9. doi: 10.1016/0165-0327(82)90010-6. PMID: 6215444. 2: Maguire KP, Norman TR, McIntyre I, Burrows GD, Davies B. Blood and plasma concentrations of dothiepin and its major metabolites and clinical response. J Affect Disord. 1982 Mar;4(1):41-8. doi: 10.1016/0165-0327(82)90018-0. PMID: 6461686. 3: Maguire KP, Norman TR, Burrows GD, Scoggins BA. Simultaneous measurement of dothiepin and its major metabolites in plasma and whole blood by gas chromatography-mass fragmentography. J Chromatogr. 1981 Mar 13;222(3):399-408. doi: 10.1016/s0378-4347(00)84140-7. PMID: 7228947.