MedKoo Cat#: 573515 | Name: AJG-049 HCl

Description:

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

AJG-049 HCl is a calcium channel antagonist that inhibits L-type Ca2+ channels via diltiazem-binding site(s).

Chemical Structure

AJG-049 HCl
AJG-049 HCl
CAS#195991-50-5

Theoretical Analysis

MedKoo Cat#: 573515

Name: AJG-049 HCl

CAS#: 195991-50-5

Chemical Formula: C27H31ClN2O2

Exact Mass: 450.2074

Molecular Weight: 451.01

Elemental Analysis: C, 71.91; H, 6.93; Cl, 7.86; N, 6.21; O, 7.09

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 #
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Synonym
AJG-049 HCl, AJG-049 hydrochloride
IUPAC/Chemical Name
11-(((2R)-1-(2-(4-Methoxyphenyl)ethyl)pyrrolidin-2-yl)methyl)-6H-benzo(C)(1,5)benzoxazepine hydrochloride
InChi Key
QVEPWCHFXPHWJG-GNAFDRTKSA-N
InChi Code
1S/C27H30N2O2.ClH/c1-30-24-14-12-21(13-15-24)16-18-28-17-6-8-23(28)19-29-25-9-3-2-7-22(25)20-31-27-11-5-4-10-26(27)29;/h2-5,7,9-15,23H,6,8,16-20H2,1H3;1H/t23-;/m1./s1
SMILES Code
Cl.COc1ccc(CCN2CCC[C@@H]2CN3c4ccccc4COc5ccccc35)cc1
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
>3 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 451.01 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: Zhu HL, Hashimoto M, Teramoto N. Dual action of AJG049, a novel gut selective Ca2+ channel antagonist, on Ba2+ currents and contractions in guinea-pig antrum myocytes. Eur J Pharmacol. 2009 Mar 1;605(1-3):138-44. doi: 10.1016/j.ejphar.2008.12.039. Epub 2009 Jan 10. PubMed PMID: 19168048. 2: Hashimoto M, Teramoto N, Zhu HL, Takahashi K, Ito Y. Comparative studies of AJG049, a novel Ca2+ channel antagonist, on voltage-dependent L-type Ca2+ currents in intestinal and vascular smooth muscle. Br J Pharmacol. 2006 Sep;149(2):155-62. Epub 2006 Aug 14. PubMed PMID: 16921392; PubMed Central PMCID: PMC2013798.