WARNING: This product is for research use only, not for human or veterinary use.
Hodoodo CAT#: H530310
CAS#: 142494-13-1 (fumarate)
Description: Org-13011 fumarate is a 5-HT1A receptor agonist.
Hodoodo Cat#: H530310
Name: Org-13011 fumarate
CAS#: 142494-13-1 (fumarate)
Chemical Formula: C22H29F3N4O5
Exact Mass: 0.00
Molecular Weight: 486.492
Elemental Analysis: C, 54.32; H, 6.01; F, 11.72; N, 11.52; O, 16.44
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Synonym: Org-13011 fumarate; Org 13011; Org13011.
IUPAC/Chemical Name: 2-Pyrrolidinone, 1-(4-(4-(4-(trifluoromethyl)-2-pyridinyl)-1-piperazinyl)butyl)-, (E)-2-butenedioate
InChi Key: KILJTUTVUORPFQ-WLHGVMLRSA-N
InChi Code: InChI=1S/C18H25F3N4O.C4H4O4/c19-18(20,21)15-5-6-22-16(14-15)24-12-10-23(11-13-24)7-1-2-8-25-9-3-4-17(25)26;5-3(6)1-2-4(7)8/h5-6,14H,1-4,7-13H2;1-2H,(H,5,6)(H,7,8)/b;2-1+
SMILES Code: O=C1N(CCCCN2CCN(C3=NC=CC(C(F)(F)F)=C3)CC2)CCC1.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
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# 142494-12-0 (Org-13011 free base) 142494-13-1 (Org-13011 fumarate)
Biological target: | |
In vitro activity: | |
In vivo activity: |
The following data is based on the product molecular weight 486.49 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: van Hoof P, Lammers R, v Puijenbroek R, v d Schans M, Carlier P, Kellenbach E.
Polymorphism of the CNS active drug Org 13011: the application of high
temperature analysis to detect new polymorphs. Int J Pharm. 2002 May
15;238(1-2):215-28. PubMed PMID: 11996825.
2: Berendsen HH, Broekkamp CL. Antagonism of the 5-HT1A receptor stimulus in a
conditioned taste aversion procedure. Eur Neuropsychopharmacol. 1999
Jun;9(4):345-9. PubMed PMID: 10422896.