SMP-797 HCl | CAS#259224-95-8 | acyl-CoA-cholesterol acyltransferase inhibitor

MedKoo Cat#: 530123 | Name: SMP-797 HCl

Description:

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

An ACAT (acyl-CoA-cholesterol acyltransferase) inhibitor potentially for the treatment of Hyperlipidemia.

Chemical Structure

SMP-797 HCl

CAS#259224-95-8 (HCl)

Theoretical Analysis

MedKoo Cat#: 530123

Name: SMP-797 HCl

CAS#: 259224-95-8 (HCl)

Chemical Formula: C34H44ClN5O4

Exact Mass:

Molecular Weight: 622.21

Elemental Analysis: C, 65.63; H, 7.13; Cl, 5.70; N, 11.26; O, 10.29

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.

Bulk Inquiry

Related CAS #

No Data

Synonym

SMP-797; SMP797; SMP 797

IUPAC/Chemical Name

1-(4-amino-2,6-diisopropylphenyl)-3-(1-butyl-4-(3-(3-hydroxypropoxy)phenyl)-2-oxo-1,2-dihydro-1,8-naphthyridin-3-yl)urea hydrochloride

InChi Key

FAFVVBJEQCPDIA-UHFFFAOYSA-N

InChi Code

InChI=1S/C34H43N5O4.ClH/c1-6-7-15-39-32-26(13-9-14-36-32)29(23-11-8-12-25(18-23)43-17-10-16-40)31(33(39)41)38-34(42)37-30-27(21(2)3)19-24(35)20-28(30)22(4)5;/h8-9,11-14,18-22,40H,6-7,10,15-17,35H2,1-5H3,(H2,37,38,42);1H

SMILES Code

O=C(NC1=C(C2=CC=CC(OCCCO)=C2)C3=CC=CN=C3N(CCCC)C1=O)NC4=C(C(C)C)C=C(N)C=C4C(C)C.[H]Cl

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# 437763-85-4(SMP-797 Free base) 259224-95-8(SMP-797 HCl)

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 622.21 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: Asano S, Ban H, Kino K, Ioriya K, Muraoka M. Synthesis and structure-activity relationships of N-(4-amino-2,6-diisopropylphenyl)-N'-(1,4-diarylpiperidine-4-yl)methylureas as anti-hyperlipidemic agents. Bioorg Med Chem. 2009 Jul 1;17(13):4636-46. doi: 10.1016/j.bmc.2009.04.059. PubMed PMID: 19464189. 2: Asano S, Ban H, Kino K, Ioriya K, Muraoka M. Novel 1,4-diarylpiperidine-4-methylureas as anti-hyperlipidemic agents: dual effectors on acyl-CoA:cholesterol O-acyltransferase and low-density lipoprotein receptor expression. Bioorg Med Chem Lett. 2009 Feb 15;19(4):1062-5. doi: 10.1016/j.bmcl.2009.01.020. PubMed PMID: 19167888. 3: Kitamura A, Imai S, Yabuki M, Komuro S. The new acyl-CoA cholesterol acyltransferase inhibitor SMP-797 does not interact with statins via OATP1B1 in human cryopreserved hepatocytes and oocytes expressing systems. Biopharm Drug Dispos. 2007 Dec;28(9):517-25. PubMed PMID: 17918775. 4: Ioriya K, Kino K, Horisawa S, Nishimura T, Muraoka M, Noguchi T, Ohashi N. Pharmacological profile of SMP-797, a novel acyl-coenzyme a: cholesterol acyltransferase inhibitor with inducible effect on the expression of low-density lipoprotein receptor. J Cardiovasc Pharmacol. 2006 Feb;47(2):322-9. PubMed PMID: 16495773. 5: Ban H, Muraoka M, Ioriya K, Ohashi N. Synthesis and biological activity of novel 4-phenyl-1,8-naphthyridin-2(1H)-on-3-yl ureas: potent acyl-CoA:cholesterol acyltransferase inhibitor with improved aqueous solubility. Bioorg Med Chem Lett. 2006 Jan 1;16(1):44-8. PubMed PMID: 16242323. 6: Bayés M, Rabasseda X, Prous JR. Gateways to clinical trials. Methods Find Exp Clin Pharmacol. 2005 Jan-Feb;27(1):49-77. PubMed PMID: 15834459.