MedKoo Cat#: 529612 | Name: PNU-96391

Description:

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

PNU-96391, also known as OSU-6162, is a dopamine D2 antagonist and a 5-HT2A partial agonist potentially for the treatment of chronic

Chemical Structure

PNU-96391
PNU-96391
CAS#146798-66-5 (free base)

Theoretical Analysis

MedKoo Cat#: 529612

Name: PNU-96391

CAS#: 146798-66-5 (free base)

Chemical Formula: C15H23NO2S

Exact Mass: 281.1449

Molecular Weight: 281.41

Elemental Analysis: C, 64.02; H, 8.24; N, 4.98; O, 11.37; S, 11.39

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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Synonym
PNU-96391; OSU-6162; PNU96391; OSU6162; PNU 96391; OSU 6162; (S)-(-)-OSU-6162
IUPAC/Chemical Name
3-(3-(methylsulfonyl)phenyl)-1-propylpiperidine
InChi Key
GZVBVBMMNFIXGE-UHFFFAOYSA-N
InChi Code
InChI=1S/C15H23NO2S/c1-3-9-16-10-5-7-14(12-16)13-6-4-8-15(11-13)19(2,17)18/h4,6,8,11,14H,3,5,7,9-10,12H2,1-2H3
SMILES Code
CCCN1CC(C2=CC=CC(S(=O)(C)=O)=C2)CCC1
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
Soluble in DMSO
Shelf Life
>2 years if stored properly
Drug Formulation
This drug may be formulated in DMSO
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 281.41 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: Yamazaki S, Toth LN, Black ML, Duncan JN. Comparison of prediction methods for in vivo clearance of (S,S)-3-[3-(methylsulfonyl)phenyl]-1-propylpiperidine hydrochloride, a dopamine D2 receptor antagonist, in humans. Drug Metab Dispos. 2004 Apr;32(4):398-404. PubMed PMID: 15039292. 2: Rodríguez CA, Azie NE, Adams G, Donaldson K, Francom SF, Staton BA, Bombardt PA. Single oral dose safety, tolerability, and pharmacokinetics of PNU-96391 in healthy volunteers. J Clin Pharmacol. 2004 Mar;44(3):276-83. PubMed PMID: 14973308. 3: Yamazaki S, Toth LN, Kimoto E, Bower J, Skaptason J, Romero D, Heath TG. Application of stable isotope methodology in the evaluation of the pharmacokinetics of (S,S)-3-[3-(methylsulfonyl)phenyl]-1-propylpiperidine hydrochloride in rats. Drug Metab Dispos. 2009 May;37(5):937-45. doi: 10.1124/dmd.108.025478. PubMed PMID: 19237512. 4: Wienkers LC, Wynalda MA. Multiple cytochrome P450 enzymes responsible for the oxidative metabolism of the substituted (S)-3-phenylpiperidine, (S,S)-3-[3-(methylsulfonyl)phenyl]-1-propylpiperidine hydrochloride, in human liver microsomes. Drug Metab Dispos. 2002 Dec;30(12):1372-7. PubMed PMID: 12433806. 5: Hutzler JM, Powers FJ, Wynalda MA, Wienkers LC. Effect of carbonate anion on cytochrome P450 2D6-mediated metabolism in vitro: the potential role of multiple oxygenating species. Arch Biochem Biophys. 2003 Sep 15;417(2):165-75. PubMed PMID: 12941298. 6: Hadj Tahar A, Ekesbo A, Grégoire L, Bangassoro E, Svensson KA, Tedroff J, Bédard PJ. Effects of acute and repeated treatment with a novel dopamine D2 receptor ligand on L-DOPA-induced dyskinesias in MPTP monkeys. Eur J Pharmacol. 2001 Feb 2;412(3):247-54. PubMed PMID: 11166288. 7: Neu H, Hartvig P, Torstenson R, Fasth KJ, Sonesson C, Waters N, Carlsson A, Tedroff J, Långström B. Synthesis of [11C-methyl]-(-)-OSU6162, its regional brain distribution and some pharmacological effects of (-)-OSU6162 on the dopaminergic system studied in the rhesus monkey by positron emission tomography. Nucl Med Biol. 1997 Aug;24(6):507-11. PubMed PMID: 9316077.