Calhex 231 hydrochloride | CAS#2387505-78-2 | CaSR modulator

MedKoo Cat#: 462211 | Name: Calhex 231 hydrochloride

Description:

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

Calhex 231 hydrochloride is a negative allosteric modulator of calcium-sensing receptor (CaSR).

Chemical Structure

Calhex 231 hydrochloride

CAS#2387505-78-2

Theoretical Analysis

MedKoo Cat#: 462211

Name: Calhex 231 hydrochloride

CAS#: 2387505-78-2

Chemical Formula: C25H28Cl2N2O

Exact Mass: 442.1579

Molecular Weight: 443.41

Elemental Analysis: C, 67.72; H, 6.37; Cl, 15.99; N, 6.32; O, 3.61

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

Calhex 231 hydrochloride

IUPAC/Chemical Name

4-Chloro-N-[(1S,2S)-2-[[(1R)-1-(1-naphthalenyl)ethyl]amino]cyclohexyl]-benzamide hydrochloride

InChi Key

KZPHZSFSFANQIS-VJDRQTKLSA-N

InChi Code

InChI=1S/C25H27ClN2O.ClH/c1-17(21-10-6-8-18-7-2-3-9-22(18)21)27-23-11-4-5-12-24(23)28-25(29)19-13-15-20(26)16-14-19;/h2-3,6-10,13-17,23-24,27H,4-5,11-12H2,1H3,(H,28,29);1H/t17-,23?,24+;/m1./s1

SMILES Code

C[C@@H](NC1[C@@H](NC(C2=CC=C(Cl)C=C2)=O)CCCC1)C3=C4C(C=CC=C4)=CC=C3.[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

>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

Instruction

View handling instruction

Preparing Stock Solutions

The following data is based on the product molecular weight 443.41 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: Petrel C, Kessler A, Maslah F, et al. Modeling and mutagenesis of the binding site of Calhex 231, a novel negative allosteric modulator of the extracellular Ca(2+)-sensing receptor. J Biol Chem. 2003;278(49):49487-49494. doi:10.1074/jbc.M308010200 2: Kessler A, Faure H, Petrel C, et al. N1-Benzoyl-N2-[1-(1-naphthyl)ethyl]-trans-1,2-diaminocyclohexanes: Development of 4-chlorophenylcarboxamide (calhex 231) as a new calcium sensing receptor ligand demonstrating potent calcilytic activity. J Med Chem. 2006;49(17):5119-5128. doi:10.1021/jm051233+ 3: Weston AH, Absi M, Harno E, et al. The expression and function of Ca(2+)-sensing receptors in rat mesenteric artery; comparative studies using a model of type II diabetes. Br J Pharmacol. 2008;154(3):652-662. doi:10.1038/bjp.2008.108