N-(2-(Diethylamino)ethyl)-2-methoxy-5-(methylsulphonyl)benzamide monohydrochloride
Basic information
- CAS
51012-33-0- Standard SMILES
CC[NH+](CC)CCNC(=O)c1cc(S(C)(=O)=O)ccc1OC.[Cl-]- InChIKey
OTFDPNXIVHBTKW-UHFFFAOYSA-N- Molecular formula
- C15H25ClN2O4S
- Average molar mass
- 364.9 g/mol
- Monoisotopic mass
- 364.1223562
Overview
See also: Tiapride Hydrochloride (preferred); Tiapride (has active moiety).
Names & identifiers
- Preferred name
- N-(2-(Diethylamino)ethyl)-2-methoxy-5-(methylsulphonyl)benzamide monohydrochloride
- IUPAC
- diethyl-[2-[(2-methoxy-5-methylsulfonylbenzoyl)amino]ethyl]azanium chloride
- English name
- Tiapride hydrochloride
- Molecular formula
- C15H25ClN2O4S
- Molecular weight
- 364.89
Names & synonyms
N-(2-(Diethylamino)ethyl)-2-methoxy-5-(methylsulphonyl)benzamide monohydrochloridediethyl-[2-[(2-methoxy-5-methylsulfonylbenzoyl)amino]ethyl]azanium;chlorideTiapride hydrochloride [JAN]N-(2-(Diethylamino)ethyl)-5-(methylsulfonyl)-o-anisamide hydrochlorideEINECS 256-908-4UNII-25N106WEDOTiarylCuckoolTiaprimTialareadGrinolartTiapridHCl
Show more names
TiapridhydrochloridTIAPRIDE HYDROCHLORIDETiapride HCl - Bio-X ?Tiapride HCl (Tiapridal)
Database identifiers
- CAS
51012-33-0- PubChem CID
- 39855
Properties
Computed structural properties
- Topological polar surface area
- 85.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 443
Physicochemical properties
- Melting point
- 200 ℃ · approximate 200℃ (dec.)
- storage temp.
- 2 · 2-8°C
- solubility
- Very soluble in water, soluble in methanol, slightly soluble in anhydrous ethanol.
- form
- Solid
- color
- White
- Merck
- 14 · 14,9421
- Major Application
- pharmaceutical (small molecule)
- InChI
- InChI=1S/C15H24N2O4S.ClH/c1-5-17(6-2)10-9-16-15(18)13-11-12(22(4,19)20)7-8-14(13)21-3;/h7-8,11H,5-6,9-10H2,1-4H3,(H,16,18);1H
- InChIKey
- OTFDPNXIVHBTKW-UHFFFAOYSA-N
- SMILES
- C(C1C=C(S(=O)(=O)C)C=CC=1OC)(=O)NCCN(CC)CC.Cl
- CAS DataBase Reference
- 51012 · 51012-33-0(CAS DataBase Reference)
- FDA UNII
- 25 N106WEDO · 25N106WEDO
- UNSPSC Code
- 41116107 · 41116107
- NACRES
- 24 · NA.24
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- wgk
- 2
- rtecs
- CV4203800
- hs_code
- 2930.90.2900
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Storage Class
- 11 - Combustible Solids
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P261-P305+P351+P338
Chemistry & industry
Applications
UsesTiapride is a D2 and D3 dopamine receptor antagonist and a antipsychotic drug predominately used in the pharmacotherapy of patients with dementia.
UsesDopamine antagonist;Antidyskinetic
UsesTiapride hydrochloride is a D2 and D3 dopamine receptor antagonist and a antipsychotic drug predominately used in the pharmacotherapy of patients with dementia.
Upstream & downstream products
Upstream raw materials
Additional notes
DefinitionChEBI: Tiapride hydrochloride is a member of benzamides.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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