CBS-3595

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

MedKoo CAT#: 530665

CAS#: 908380-97-2

Description: CBS-3595 is a potent and Dual p38α MAPK/PDE-4 Inhibitor with Activity against TNFα -related Diseases. CBS-3595 displayed a superior profile regarding its anti-inflammatory effects. CBS-3595 features moderate inhibition of p38α MAPK and PDE-4 in the higher nanomolar range in combination with excellent kinetic properties and low plasma protein binding contributing to the outstanding results of the efficacy experiments performed in animal models and humans. The inhibition of TNFα release was achieved at dose levels and systemic concentrations that were well below levels related to toxicity. CBS-3595 is considered as a candidate drug for the treatment of diseases related to an overproduction of TNFα.

Chemical Structure

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CBS-3595
CAS# 908380-97-2
Instruction

Theoretical Analysis

MedKoo Cat#: 530665
Name: CBS-3595
CAS#: 908380-97-2
Chemical Formula: C18H17FN4O2S
Exact Mass: 372.11
Molecular Weight: 372.418
Elemental Analysis: C, 58.05; H, 4.60; F, 5.10; N, 15.04; O, 8.59; S, 8.61

Price and Availability

This product is not in stock, which may be available by custom synthesis. For cost-effective reason, minimum order is 1g (price is usually high, lead time is 2~3 months, depending on the technical challenge). Quote less than 1g will not be provided. To request quote, please email to sales @medkoo.com or click below button.
Note: Price will be listed if it is available in the future.

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Synonym: CBS-3595; CBS 3595; CBS3595.

IUPAC/Chemical Name: N-{4-[5-(4-Fluoro-phenyl)-3-methyl-2-methylsulfanyl-3H-imidazol-4-yl]-pyridin-2-yl}-acetamide

InChi Key: DRMJRHUMYBYDIX-UHFFFAOYSA-N

InChi Code: InChI=1S/C18H17FN4O2S/c1-11(24)21-15-10-13(8-9-20-15)17-16(12-4-6-14(19)7-5-12)22-18(23(17)2)26(3)25/h4-10H,1-3H3,(H,20,21,24)

SMILES Code: CC(NC1=NC=CC(C2=C(C3=CC=C(F)C=C3)N=C(S(C)=O)N2C)=C1)=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:

Biological target:
In vitro activity:
In vivo activity:

Preparing Stock Solutions

The following data is based on the product molecular weight 372.42 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
Formulation protocol:
In vitro protocol:
In vivo protocol:

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1: Albrecht W, Unger A, Bauer SM, Laufer SA. Discovery of
N-{4-[5-(4-Fluoro-phenyl)-3-methyl-2-methylsulfanyl-3H-imidazol-4-yl]-pyridin-2-y
l}-acetamide (CBS-3595), a Dual p38α MAPK/PDE-4 Inhibitor with Activity against
TNFα -related Diseases. J Med Chem. 2017 Jun 14. doi:
10.1021/acs.jmedchem.6b01647. [Epub ahead of print] PubMed PMID: 28613871.


2: Koch DA, Silva RB, de Souza AH, Leite CE, Nicoletti NF, Campos MM, Laufer S,
Morrone FB. Efficacy and gastrointestinal tolerability of ML3403, a selective
inhibitor of p38 MAP kinase and CBS-3595, a dual inhibitor of p38 MAP kinase and
phosphodiesterase 4 in CFA-induced arthritis in rats. Rheumatology (Oxford). 2014
Mar;53(3):425-32. doi: 10.1093/rheumatology/ket369. Epub 2013 Nov 15. PubMed
PMID: 24241037.