WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H130468
CAS#: 684238-05-9
Description: STOCK3S-30866 is an allosteric inhibitor of the human serotonin transporter (hSERT).
Hodoodo Cat#: H130468
Name: STOCK3S-30866
CAS#: 684238-05-9
Chemical Formula: C28H23FN4O2S
Exact Mass: 498.15
Molecular Weight: 498.580
Elemental Analysis: C, 67.45; H, 4.65; F, 3.81; N, 11.24; O, 6.42; S, 6.43
This product is not in stock, which may be available by custom synthesis.
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Synonym: STOCK3S-30866; STOCK3S30866; STOCK3S 30866
IUPAC/Chemical Name: 2-((3-Cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)-N-(9-ethyl-9H-carbazol-3-yl)acetamide
InChi Key: VGFPKMRXUBHBLZ-UHFFFAOYSA-N
InChi Code: InChI=1S/C28H23FN4O2S/c1-2-33-24-10-6-4-8-19(24)21-13-17(11-12-25(21)33)31-27(35)16-36-28-22(15-30)20(14-26(34)32-28)18-7-3-5-9-23(18)29/h3-13,20H,2,14,16H2,1H3,(H,31,35)(H,32,34)
SMILES Code: O=C(NC1=CC2=C(C=C1)N(CC)C3=C2C=CC=C3)CSC4=C(C#N)C(C5=CC=CC=C5F)CC(N4)=O
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:
Biological target: | |
In vitro activity: | |
In vivo activity: |
The following data is based on the product molecular weight 498.58 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.
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 |
Formulation protocol: | |
In vitro protocol: | |
In vivo protocol: |
1. Ayipo YO, Ahmad I, Chong CF, Zainurin NA, Najib SY, Patel H, Mordi MN. Carbazole derivatives as promising competitive and allosteric inhibitors of human serotonin transporter: computational pharmacology. J Biomol Struct Dyn. 2023 Apr 6:1-22. doi: 10.1080/07391102.2023.2198016. Epub ahead of print. PMID: 37021485.