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Chemical structure of Metoclopramide (hydrochloride)

GC44186

Metoclopramide (hydrochloride)

Also known as 4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide;hydrochloride

Metoclopramide is an orally bioavailable serotonin (5-HT) receptor 5-HT3 antagonist with Ki and IC50 values of 995 and 308 nM, respectively, in rat cortical membranes

ChemicalCAS7232-21-5MW336.3FormulaC14H22ClN3O2•HCl
CAS number
7232-21-5
Molecular weight
336.3
Formula
C14H22ClN3O2•HCl
Solubility
DMF： 20 mg/ml,DMSO： 20 mg/ml,Ethanol： 20 mg/ml,PBS (pH 7·2)： 10 mg/ml
InChIKey
RVFUNJWWXKCWNS-UHFFFAOYSA-N
Catalogue number
GC44186
Brand
GLPBIO
Computed properties PubChem CID 23659 · TPSA 67.6 Ų · H-bond donors 3 · H-bond acceptors 4
TPSA
67.6 Ų
H-bond donors
3
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
21

SMILES CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Cl.Cl

Computed descriptors from PubChem (CID 23659), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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