JNJ-41443532 monohydrate | CAS#1228651-46-4 | CCR2 receptor antagonist

MedKoo Cat#: 125568 | Name: JNJ-41443532 monohydrate

Description:

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

JNJ-41443532 Free Base is a CCR2 receptor antagonist. It is used for the oral treatment of type-2 diabetes mellitus. A phase I trial in healthy volunteers was completed in Belgium, and a phase II trial in patients with type 2 diabetes was completed in the US.

Chemical Structure

JNJ-41443532 monohydrate

CAS#1228651-46-4 (H2O)

Theoretical Analysis

MedKoo Cat#: 125568

Name: JNJ-41443532 monohydrate

CAS#: 1228651-46-4 (H2O)

Chemical Formula: C22H27F3N4O4S

Exact Mass: 500.1700

Molecular Weight: 500.54

Elemental Analysis: C, 52.79; H, 5.44; F, 11.39; N, 11.19; O, 12.79; S, 6.41

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 #

1228651-46-4 (H2O) 1228650-83-6 (free base)

Synonym

JNJ-41443532 monohydrate; JNJ-41443532-zap; UNII-8J1751T2GG; 8J1751T2GG; 1228651-46-4

IUPAC/Chemical Name

N-(2-((1-((1r,4r)-4-hydroxy-4-(thiazol-5-yl)cyclohexyl)azetidin-3-yl)amino)-2-oxoethyl)-3-(trifluoromethyl)benzamide hydrate

InChi Key

WWTMICIGZQMWGD-RJHLRSTHSA-N

InChi Code

InChI=1S/C22H25F3N4O3S.H2O/c23-22(24,25)15-3-1-2-14(8-15)20(31)27-10-19(30)28-16-11-29(12-16)17-4-6-21(32,7-5-17)18-9-26-13-33-18;/h1-3,8-9,13,16-17,32H,4-7,10-12H2,(H,27,31)(H,28,30);1H2/t17-,21-;

SMILES Code

O.O[C@]1(CC[C@@H](CC1)N2CC(C2)NC(=O)CNC(=O)C3=CC=CC(=C3)C(F)(F)F)C4=CN=CS4

Appearance

To be determined

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

To be determined

Shelf Life

>2 years if stored properly

Drug Formulation

To be determined

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 500.54 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: Di Prospero NA, Artis E, Andrade-Gordon P, Johnson DL, Vaccaro N, Xi L, Rothenberg P. CCR2 antagonism in patients with type 2 diabetes mellitus: a randomized, placebo-controlled study. Diabetes Obes Metab. 2014 Nov;16(11):1055-64. doi: 10.1111/dom.12309. Epub 2014 May 25. PubMed PMID: 24798870.