SIM-6080 | CAS#118790-68-4 | Calcium Channel Antagonist

MedKoo Cat#: 528529 | Name: SIM-6080

Description:

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

SIM-6080 is a calcium channel antagonist for the treatment of hyperlipidemia and myocardia ischemia. SIM-6080 inhibited the proliferation of rat aortic myocytes.

Chemical Structure

SIM-6080

CAS#118790-68-4

Theoretical Analysis

MedKoo Cat#: 528529

Name: SIM-6080

CAS#: 118790-68-4

Chemical Formula: C29H36F2N2O3

Exact Mass: 498.2694

Molecular Weight: 498.61

Elemental Analysis: C, 69.86; H, 7.28; F, 7.62; N, 5.62; O, 9.63

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 #

No Data

Synonym

SIM-6080; SIM 6080; SIM6080

IUPAC/Chemical Name

N1-(3,3-bis(4-fluorophenyl)propyl)-N1,N2-dimethyl-N2-(3,4,5-trimethoxybenzyl)ethane-1,2-diamine

InChi Key

NOMSFNRBXCWAIE-UHFFFAOYSA-N

InChi Code

InChI=1S/C29H36F2N2O3/c1-32(16-17-33(2)20-21-18-27(34-3)29(36-5)28(19-21)35-4)15-14-26(22-6-10-24(30)11-7-22)23-8-12-25(31)13-9-23/h6-13,18-19,26H,14-17,20H2,1-5H3

SMILES Code

COC1=C(OC)C(OC)=CC(CN(C)CCN(CCC(C2=CC=C(F)C=C2)C3=CC=C(F)C=C3)C)=C1

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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 498.61 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

1: Castelnovo P. Determination of the calcium antagonist SIM6080 and its N- and O-demethylated metabolites in plasma, urine and tissues by high-performance liquid chromatography. J Chromatogr B Biomed Appl. 1996 Feb 9;676(1):77-85. PubMed PMID: 8852047. 2: Castelnovo P. Determination of the calcium antagonist SIM6080 in plasma by high-resolution gas chromatography. J Chromatogr. 1994 Feb 11;652(2):240-4. PubMed PMID: 8006110. 3: Maggi FM, Bernini F, Barberi L, Fantoni M, Catapano AL. SIM 6080, a new calcium antagonist, reduces aortic atherosclerosis in cholesterol-fed rabbits. Pharmacol Res. 1993 Oct-Nov;28(3):219-27. PubMed PMID: 8108312. 4: Bernini F, Fantoni M, Corsini A, Fumagalli R. In vitro inhibition of arterial myocyte growth and stimulation of low density lipoprotein metabolism by SIM 6080, a new calcium antagonist. Pharmacol Res. 1990 Jan-Feb;22(1):27-35. PubMed PMID: 2330336.