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MedKoo Cat#: 524244 | Name: Aplindore fumarate

Description:

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

Aplindore Fumarate is a dopamine receptor agonist used in the therapeutic treatment of Parkinson Disease.

Chemical Structure

Aplindore fumarate
Aplindore fumarate
CAS#189681-71-8 (fumarate)

Theoretical Analysis

MedKoo Cat#: 524244

Name: Aplindore fumarate

CAS#: 189681-71-8 (fumarate)

Chemical Formula: C22H22N2O7

Exact Mass: 426.1427

Molecular Weight: 426.42

Elemental Analysis: C, 61.97; H, 5.20; N, 6.57; O, 26.26

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 #
189681-71-8 (fumarate) 189681-70-7 (free base)
Synonym
Aplindore Fumarate; Aplindore; Palindore; WAY-DAB 452; WAY-DAB452; WAY-DAB452; DAB 452; DAB-452; DAB452;
IUPAC/Chemical Name
(2S)-2-((Benzylamino)methyl)-2,3,7,9-tetrahydro-8H-1,4-dioxino(2,3-e)indol-8-one fumarate
InChi Key
GELJVTSEGKGLDF-QDSMGTAFSA-N
InChi Code
InChI=1S/C18H18N2O3.C4H4O4/c21-17-8-14-15(20-17)6-7-16-18(14)23-13(11-22-16)10-19-9-12-4-2-1-3-5-12;5-3(6)1-2-4(7)8/h1-7,13,19H,8-11H2,(H,20,21);1-2H,(H,5,6)(H,7,8)/b;2-1+/t13-;/m0./s1
SMILES Code
O=C1NC2=C(C(O[C@@H](CNCC3=CC=CC=C3)CO4)=C4C=C2)C1.O=C(O)/C=C/C(O)=O
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, not in water
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
Related CAS# 189681-70-7(Aplindore free base)

Preparing Stock Solutions

The following data is based on the product molecular weight 426.42 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: Jackson MJ, Andree TH, Hansard M, Hoffman DC, Hurtt MR, Kehne JH, Pitler TA, Smith LA, Stack G, Jenner P. The dopamine D(2) receptor partial agonist aplindore improves motor deficits in MPTP-treated common marmosets alone and combined with L-dopa. J Neural Transm (Vienna). 2010 Jan;117(1):55-67. doi: 10.1007/s00702-009-0323-9. Epub 2009 Oct 7. PubMed PMID: 19809864. 2: Heinrich JN, Brennan J, Lai MH, Sullivan K, Hornby G, Popiolek M, Jiang LX, Pausch MH, Stack G, Marquis KL, Andree TH. Aplindore (DAB-452), a high affinity selective dopamine D2 receptor partial agonist. Eur J Pharmacol. 2006 Dec 15;552(1-3):36-45. Epub 2006 Sep 14. PubMed PMID: 17056032.