1-arylmethylpyrrolidin-2-yl ethanol amine , CAS No.A607083, Antagonist of CaS receptor

Item Number
A607083
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A607083-5mg
5mg
Available within 8-12 weeks(?)
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$1,334.90
A607083-25mg
25mg
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$1,900.90
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CaS receptor Antagonist

Basic Description

Specifications & PurityMoligand™
GradeMoligand™
Action TypeANTAGONIST
Mechanism of actionAntagonist of CaS receptor

Associated Targets(Human)

CASR Tclin Extracellular calcium-sensing receptor (1 Activities)
Activity TypeActivity Value -log(M)Mechanism of ActionActivity ReferencePublications (PubMed IDs)

Mechanisms of Action

Mechanism of ActionAction Typetarget IDTarget NameTarget TypeTarget OrganismBinding Site NameReferences

Names and Identifiers

IUPAC Name 3-{[(2R)-2-[(1R)-2-{[1-(1-benzothiophen-2-yl)-2-methylpropan-2-yl]amino}-1-hydroxyethyl]pyrrolidin-1-yl]methyl}benzonitrile
INCHI InChI=1S/C26H31N3OS/c1-26(2,15-22-14-21-9-3-4-11-25(21)31-22)28-17-24(30)23-10-6-12-29(23)18-20-8-5-7-19(13-20)16-27/h3-5,7-9,11,13-14,23-24,28,30H,6,10,12,15,17-18H2,1-2H3/t23-,24-/m1/s1
InChi Key HCLQARMRCPEALF-DNQXCXABSA-N
Canonical SMILES N#Cc1cccc(c1)CN1CCC[C@@H]1[C@@H](CNC(Cc1cc2c(s1)cccc2)(C)C)O
Isomeric SMILES CC(C)(CC1=CC2=CC=CC=C2S1)NC[C@H]([C@H]3CCCN3CC4=CC(=CC=C4)C#N)O
PubChem CID 44405854

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Related Documents

References

1. Gavai AV, Vaz RJ, Mikkilineni AB, Roberge JY, Liu Y, Lawrence RM, Corte JR, Yang W, Bednarz M, Dickson Jr JK et al..  (2005)  Discovery of novel 1-arylmethyl pyrrolidin-2-yl ethanol amines as calcium-sensing receptor antagonists..  Bioorg Med Chem Lett,  15  (24): (5478-82).  [PMID:16216508] [10.1021/op500134e]

Solution Calculators