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Small Molecules & Compound Libraries
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GPCR/G Protein
5-HT Receptor
metoclopramide hydrochloride - 10mM in DMSO, high purity , CAS No.54143-57-6, Serotonin 4 (5-HT4) receptor agonist

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metoclopramide hydrochloride - 10mM in DMSO, high purity , CAS No.54143-57-6, Serotonin 4 (5-HT4) receptor agonist

COA

Grade & Purity:

10mM in DMSO

Cas Number: 54143-57-6
Molecular Weight: 354.27
PubChem CID: 441347

In stock

Item Number

M424624

Grouped product items
SKU	Size	Availability	Price	Qty
M424624-1ml	1ml	Available within 4-8 weeks(?) Items will be manufactured post-order and can take 4-8 weeks. Thank you for your patience!	$69.90

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Class A GPCR (4138) Compound libraries (12325)

Basic Description

Synonyms	54143-57-6 \| Reglan \| metoclopramide hydrochloride hydrate \| metoclopramide hcl monohydrate \| Metoclopramide hydrochloride monohydrate \| Maxolon \| metipamid \| AHR-3070-C \| Metoclopramide monohydrochloride monohydrate \| Metoclopramide (hydrochloride hydrate) \| Metozolv \| CHEBI:
Specifications & Purity	10mM in DMSO
Storage Temp	Store at -80°C
Shipped In	Ice chest + Ice pads This product requires cold chain shipping. Ground and other economy services are not available.
Action Type	ANTAGONIST
Mechanism of action	Serotonin 4 (5-HT4) receptor agonist

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Benzoic acids and derivatives
      - Level5 Aminobenzoic acids and derivatives
        Level6 Aminobenzamides

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Benzoic acids and derivatives
Intermediate Tree Nodes	Aminobenzoic acids and derivatives
Direct Parent	Aminobenzamides
Alternative Parents	3-halobenzoic acids and derivatives Aminophenyl ethers Methoxyanilines Benzamides Phenoxy compounds Methoxybenzenes Anisoles Benzoyl derivatives Alkyl aryl ethers Chlorobenzenes Aryl chlorides Trialkylamines Secondary carboxylic acid amides Amino acids and derivatives Hydrocarbon derivatives Hydrochlorides Organic oxides Organochlorides Organopnictogen compounds Primary amines
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Aminobenzamide - 3-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzamide - Aminophenyl ether - Methoxyaniline - Anisole - Phenoxy compound - Benzoyl - Phenol ether - Aniline or substituted anilines - Methoxybenzene - Alkyl aryl ether - Chlorobenzene - Halobenzene - Aryl chloride - Aryl halide - Secondary carboxylic acid amide - Amino acid or derivatives - Carboxamide group - Tertiary aliphatic amine - Tertiary amine - Carboxylic acid derivative - Ether - Organic nitrogen compound - Organohalogen compound - Organochloride - Organonitrogen compound - Organooxygen compound - Amine - Hydrocarbon derivative - Organopnictogen compound - Hydrochloride - Organic oxygen compound - Organic oxide - Primary amine - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as aminobenzamides. These are organic compounds containing a benzamide moiety with an amine group attached to the benzene ring.
External Descriptors	hydrate - hydrochloride
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Associated Targets(non-human)

rep Replicase polyprotein 1ab (378 Activities)

Discover Target: rep

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Mechanisms of Action

Mechanism of Action	Action Type	target ID	Target Name	Target Type	Target Organism	Binding Site Name	References

Names and Identifiers

IUPAC Name	4-amino-5-chloro-N-[2-(diethylamino)ethyl]-2-methoxybenzamide;hydrate;hydrochloride
INCHI	InChI=1S/C14H22ClN3O2.ClH.H2O/c1-4-18(5-2)7-6-17-14(19)10-8-11(15)12(16)9-13(10)20-3;;/h8-9H,4-7,16H2,1-3H3,(H,17,19);1H;1H2
InChIKey	KJBLQGHJOCAOJP-UHFFFAOYSA-N
Smiles	CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Cl.O.Cl
Isomeric SMILES	CCN(CC)CCNC(=O)C1=CC(=C(C=C1OC)N)Cl.O.Cl
PubChem CID	441347
Molecular Weight	354.27

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Flash Point(°C)	207°C
Boil Point(°C)	418.7°C
Molecular Weight	354.300 g/mol
XLogP3
Hydrogen Bond Donor Count	4
Hydrogen Bond Acceptor Count	5
Rotatable Bond Count	7
Exact Mass	353.127 Da
Monoisotopic Mass	353.127 Da
Topological Polar Surface Area	68.600 Å²
Heavy Atom Count	22
Formal Charge	0
Complexity	300.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	3

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