MDL 105,212 hydrochlorideA non-peptide tachykinin antagonist with high affinity for NK1 and NK2 receptors.

MDL 105,212 hydrochloride (CAS 167261-59-8)

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Synonym: 1-[2-[(3R)-3-(3,4-dichlorophenyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]ethyl]-4-phenylpiperidine-4-carboxamide hydrochloride
Application: A non-peptide tachykinin antagonist with high affinity for NK1 and NK2 receptors.
CAS Number: 167261-59-8
Molecular Weight: 677.06
Molecular Formula: C34H39Cl2N3O5•HCl
* Refer to Certificate of Analysis for lot specific data (including water content).
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MDL 105,212 hydrochloride is a non-peptide tachykinin antagonist that has high affinity for NK1 and NK2 receptors.


References

Identification and chemical synthesis of MDL 105,212, a non-peptide tachykinin antagonist with high affinity for NK1 and NK2 receptors: T.P. Burkholder, et al.; Bioorg. Med. Chem. Lett. 6, 951 (1996) In vitro and in vivo characterization of MDL 105,212A, a nonpeptide NK-1/NK-2 tachykinin receptor antagonist: E.M. Kudlacz, et al.; J. Pharmacol. Exp. Ther. 277, 840 (1996) Effect of MDL 105,212, a nonpeptide NK-1/NK-2 receptor antagonist in an allergic guinea pig model: E.M. Kudlacz, et al.; J. Pharmacol. Exp. Ther. 279, 732 (1996)

Physical State :
Solid
Solubility :
Soluble in water.
Storage :
Store at 4° C
Refractive Index :
n20D 1.59 (Predicted)
IC50 :
NK-1R: IC50 = 3 nM (human); Histamine H1 Receptor: IC50 = 3 nM (human); NK-2R: IC50 = 8 nM (human)
Ki Data :
NK-2R: Ki= 1 nM (human); NK-1R: Ki= 3 nM (human); NK-3R: Ki= 0.2 µM (human)
For Research Use Only. Not Intended for Diagnostic or Therapeutic Use.
PubChem CID :
153995
MDL Number :
MFCD01861939
SMILES :
COC1=CC(=CC(=C1OC)OC)C(=O)N2CC[C@](C2)(CCN3CCC(CC3)(C4=CC=CC=C4)C(=O)N)C5=CC(=C(C=C5)Cl)Cl.Cl

Download SDS (MSDS)

Certificate of Analysis

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