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Trimethobenzamide Hydrochloride

CAT: 0572-TRC-T795845-250MGSize: 250 mgDry Ice: NoHazardous: No
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CAT#:0572-TRC-T795845-250MGSize:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
554-92-7
Synonyms
Benzamide, N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3,4,5-trimethoxy-, hydrochloride (1:1); Benzamide, N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3,4,5-trimethoxy-, monohydrochloride (9CI); Benzamide, N-[p-[2-(dimethylamino)ethoxy]benzyl]-3,4,5-trimethoxy-, hydrochloride (6CI,7CI); Benzamide, N-[p-[2-(dimethylamino)ethoxy]benzyl]-3,4,5-trimethoxy-, monohydrochloride (8CI); 4-(2-Dimethylaminoethoxy)-N-(3,4,5-trimethoxybenzoyl)benzylamine hydrochloride; Anaus; N-[p-[2-(Dimethylamino)ethoxy]benzyl]-3,4,5-trimethoxybenzamide hydrochloride; Ro 2-9578; Tigan; Tigan hydrochloride; Trimethobenzamide hydrochloride; Xametina
Hazard Statement
Harmful if swallowed.
Purity
>95% (HPLC)
Smiles
Cl.COc1cc(cc(OC)c1OC)C(=O)NCc2ccc(OCCN(C)C)cc2
Molecular Formula
C21 H28 N2 O5 . Cl H
Molecular Weight
424.92
InChI
InChI=1S/C21H28N2O5.ClH/c1-23(2)10-11-28-17-8-6-15(7-9-17)14-22-21(24)16-12-18(25-3)20(27-5)19(13-16)26-4;/h6-9,12-13H,10-11,14H2,1-5H3,(H,22,24);1H
Additionnal Information
IUPAC name: N-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3,4,5-trimethoxybenzamide;hydrochloride
Shipping Conditions
Room Temperature
Storage Conditions
+4°C

Chemical Information

Trimethobenzamide Hydrochloride

Trimethobenzamide Hydrochloride is the hydrochloride salt form of trimethobenzamide, a benzamide derivative with an antiemetic property. Although the mechanism of action is largely unknown, it inhibits the chemoreceptor trigger zone (CTZ), an area in the medulla oblongata through which emetic impulses are conveyed to the vomiting center, thereby suppressing nausea and vomiting.

CAS Number554-92-7
PubChem CID68385
IUPAC NameN-[[4-[2-(dimethylamino)ethoxy]phenyl]methyl]-3,4,5-trimethoxybenzamide;hydrochloride
Molecular FormulaC21H29ClN2O5
Molecular Weight424.9
Topological Polar Surface Area69.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count29
Formal Charge0
Complexity440
SMILES
CN(C)CCOC1=CC=C(C=C1)CNC(=O)C2=CC(=C(C(=C2)OC)OC)OC.Cl
InChI
InChI=1S/C21H28N2O5.ClH/c1-23(2)10-11-28-17-8-6-15(7-9-17)14-22-21(24)16-12-18(25-3)20(27-5)19(13-16)26-4;/h6-9,12-13H,10-11,14H2,1-5H3,(H,22,24);1H
InChIKey
WIIZEEPFHXAUND-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Trimethobenzamide Hydrochloride
CAS: 554-92-7
CID: 68385
Formula: C21H29ClN2O5
MW: 424.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight424.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass424.1764997
Monoisotopic Mass424.1764997
Topological Polar Surface Area69.3 Ų
Heavy Atom Count29
Formal Charge0
Complexity440
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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Alternative Products

CatalogName
HY-12751A-01Trimethobenzamide (hydrochloride)
MBS3842445-01Trimethobenzamide hydrochloride
A17648-200Trimethobenzamide hydrochloride 200mg
A17648-100Trimethobenzamide hydrochloride 100mg
A17648-50Trimethobenzamide hydrochloride 50mg
HY-12751AR-01Trimethobenzamide (hydrochloride) (Standard)
A17648-500Trimethobenzamide hydrochloride 500mg
CS-M-10304Trimethobenzamide Hydrochloride Impurity C
CS-O-39890Trimethobenzamide Hydrochloride Impurity D
HY-12751-01Trimethobenzamide

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