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Ibodutant

Chemical Structure : Ibodutant

CAS No.: 522664-63-7

Ibodutant (MEN-15596;MEN 15596)

Catalog No.: PC-70191Not For Human Use, Lab Use Only.

A potent and selective linear tachykinin NK2 receptor antagonist with pKb of 9.3.

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Purity & Documentation Purity: >98% (HPLC)

Biological Activity

A potent and selective linear tachykinin NK2 receptor antagonist with pKb of 9.3; displays >1,000-fold selectivity over NK1 and NK3 (pKb<6); induces a concentration-dependent rightward shift of the [βAla(8)]NKA(4-10) concentration-response curves without depressing the maximal contractile effect (3-100 nM); shows good in vivo activity after intravenous, intraduodenal, and oral administration in guinea pigs.

Irritable Bowel Syndrome

Phase 3 Clinical

Physicochemical Properties

M.Wt 644.866
Formula C37H48N4O4S
Appearance Solid
CAS No.
Storage
Solide Powder
-20 °C 12 Months; 4°C 6 Months
In Solvent
-80 °C 6 Months; -20°C 6 Months
Shipping
Solubility

10 mM in DMSO

Chemical Name/SMILES

6-methyl-N-(1-(((R)-1-oxo-3-phenyl-1-(((1-((tetrahydro-2H-pyran-4-yl)methyl)piperidin-4-yl)methyl)amino)propan-2-yl)carbamoyl)cyclopentyl)-2,3-dihydrobenzo[b]thiophene-2-carboxamide

References

1. Meini S, et al. J Pharmacol Exp Ther. 2009 May;329(2):486-95.

2. Fedi V, et al. J Med Chem. 2007 Oct 4;50(20):4793-807.

3. Santicioli P, et al. Eur J Pharmacol. 2013 Feb 28;702(1-3):32-7.

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