GSK369796 Dihydrochloride
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MedKoo CAT#: 530320

CAS#: 1010411-21-8 (HCl)

Description: GSK369796, also known as N-tert-butylisoquine, is an anti-malaria drug candidate. GSK369796 was rationally designed based on chemical, toxicological, pharmacokinetic, and pharmacodynamic considerations and was selected based on excellent activity against Plasmodium falciparum in vitro and rodent malaria parasites in vivo.


Price and Availability

Size Price Shipping out time Quantity
5mg USD 355 2 Weeks
10mg USD 550 2 Weeks
25mg USD 950 2 Weeks
50mg USD 1450 2 Weeks
100mg USD 2450 2 Weeks
Inquire bulk and customized quantity

Pricing updated 2020-10-31. Prices are subject to change without notice.

GSK369796 Dihydrochloride, purity > 98%, is in stock.


Chemical Structure

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Theoretical Analysis

MedKoo Cat#: 530320
Name: GSK369796 Dihydrochloride
CAS#: 1010411-21-8 (HCl)
Chemical Formula: C20H24Cl3N3O
Exact Mass: 428.782
Molecular Weight:
Elemental Analysis: C, 56.02; H, 5.64; Cl, 24.80; N, 9.80; O, 3.73


Related CAS #: 459133-38-1 (free base)   1010411-21-8 (HCl)    

Synonym: GSK369796 Dihydrochloride; GSK 369796; GSK-369796; GSK369796; N-tert-Butyl isoquine.

IUPAC/Chemical Name: 2-[(tert-Butylamino)methyl]-5-[(7-chloroquinolin-4-yl)amino]phenol Dihydrochloride

InChi Key: UDVALKJFXQVZSI-UHFFFAOYSA-N

InChi Code: InChI=1S/C20H22ClN3O.2ClH/c1-20(2,3)23-12-13-4-6-15(11-19(13)25)24-17-8-9-22-18-10-14(21)5-7-16(17)18;;/h4-11,23,25H,12H2,1-3H3,(H,22,24);2*1H

SMILES Code: OC1=CC(NC2=CC=NC3=CC(Cl)=CC=C23)=CC=C1CNC(C)(C)C.[H]Cl.[H]Cl


Technical Data

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


References

1: O'Neill PM, Shone AE, Stanford D, Nixon G, Asadollahy E, Park BK, Maggs JL,
Roberts P, Stocks PA, Biagini G, Bray PG, Davies J, Berry N, Hall C, Rimmer K,
Winstanley PA, Hindley S, Bambal RB, Davis CB, Bates M, Gresham SL, Brigandi RA,
Gomez-de-Las-Heras FM, Gargallo DV, Parapini S, Vivas L, Lander H, Taramelli D,
Ward SA. Synthesis, antimalarial activity, and preclinical pharmacology of a
novel series of 4'-fluoro and 4'-chloro analogues of amodiaquine. Identification
of a suitable "back-up" compound for N-tert-butyl isoquine. J Med Chem. 2009 Apr
9;52(7):1828-44. doi: 10.1021/jm8012757. PubMed PMID: 19284751.

2: O'Neill PM, Park BK, Shone AE, Maggs JL, Roberts P, Stocks PA, Biagini GA,
Bray PG, Gibbons P, Berry N, Winstanley PA, Mukhtar A, Bonar-Law R, Hindley S,
Bambal RB, Davis CB, Bates M, Hart TK, Gresham SL, Lawrence RM, Brigandi RA,
Gomez-delas-Heras FM, Gargallo DV, Ward SA. Candidate selection and preclinical
evaluation of N-tert-butyl isoquine (GSK369796), an affordable and effective
4-aminoquinoline antimalarial for the 21st century. J Med Chem. 2009 Mar
12;52(5):1408-15. doi: 10.1021/jm8012618. PubMed PMID: 19222165.