Basic information
- CAS
71-81-8- Standard SMILES
CC(C)[N+](C)(CCC(C(N)=O)(c1ccccc1)c1ccccc1)C(C)C.[I-]- InChIKey
BFSMWENDZZIWPW-UHFFFAOYSA-N- Molecular formula
- C23H33IN2O
- Average molar mass
- 480.4 g/mol
- Monoisotopic mass
- 480.16376
Overview
Isopropamide iodide is a diarylmethane.
Names & identifiers
- Preferred name
- Isopropamide Iodide
- IUPAC
- (4-amino-4-oxo-3,3-diphenylbutyl)-methyl-di(propan-2-yl)azanium iodide
- English name
- Isopropamide iodide
- Molecular formula
- C23H33IN2O
- Molecular weight
- 480.43
Names & synonyms
Isopropamide Iodide71-81-8DarbidDipramidDipramidePiaccamidePriamidePriazimideSanulcinTyrimideIsamidMarygin-M
Show more names
ISOPROPAMIDEr795579mdskf4740
Iodure d'isopropamideIoduro de isopropamidaIsoproponum iodideIsopropamide ioduroIsopropamidi iodidumE0KNA372SZ(3-Carbamoyl-3,3-diphenylpropyl)diisopropylmethylammonium iodideDTXSID30221221
Database identifiers
- CAS
71-81-8- PubChem CID
- 6284
- DTXSID
DTXSID30221221- ChEMBL
CHEMBL1200347- ChEBI
CHEBI:6044- UNII
- E0KNA372SZ
- EC Number
- 200-766-8
Properties
Computed structural properties
- Topological polar surface area
- 43.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 8
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 419
Experimental & physicochemical properties
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Animal DrugsFDA approved animal drugs -> Active ingredient
Collision Cross Section186.9 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]
Physicochemical properties
- Melting point
- 199 ℃ · 199℃ (Decomposition)
- Density
- 1.2711 · 1.2711 (estimate)
- storage temp.
- -20 °C · Store at -20°C
- Water Solubility
- Practically insoluble in water
- solubility
- 250 mg/mL · DMSO: 250 mg/mL (520.37 mM)
- form
- powder to crystal
- color
- White to Almost white
- Merck
- 14 · 14,5202
- Major Application
- pharmaceutical (small molecule)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (98%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 51 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory InformationBenzenepropanaminium, .gamma.-(aminocarbonyl)-N-methyl-N,N-bis(1-methylethyl)-.gamma.-phenyl-, iodide: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - Benzenepropanaminium, .gamma.-(aminocarbonyl)-N-methyl-N,N-bis(1-methylethyl)-.gamma.-phenyl-, iodide: Environment tier I assessment
Hazard Classes and CategoriesSkin Irrit. 2 (98%)
Safety data
- wgk
- 2
- rtecs
- BP0693200
- hs_code
- 2924296000
- Toxicity
- LD50 oral in rat: > 10gm/kg
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 26-36
Chemistry & industry
Applications
UsesIsopropamide Iodide acts as an anticholinergic compound with inhibitory activity. Also acts as a muscarinic receptor antagonist which can be applied to treatment of diseases affecting cognition including Alzheimer’s disease.
UsesIsopropamide inhibits muscarinic action of acetylcholine on postganglionic parasympathetic effector regions. It is used for treating stomach ulcers and inflamed intestine.
General DescriptionIsopropamide iodide, 3-carbamoyl-3,3-diphenylpropyl)diisopropylmethylammoniumiodide (Darbid), occurs as a bitter, white to pale yellow, crystallinepowder that is only sparingly soluble in water butfreely soluble in chloroform and alcohol.This drug, introduced in 1957, is a potent anticholinergic,producing atropine-like effects peripherally. Even with itsquaternary nature, it does not cause sympathetic blockade atthe ganglionic level except at high dosages. Its principal distinguishingfeature is its long duration of action. A singledose can provide antispasmodic and antisecretory effects foras long as 12 hours.
Upstream & downstream products
Upstream raw materials
Suppliers54 total
国药集团化学试剂有限公司86-21-63210123 · [email protected]
成都超九八生物科技有限公司13348960310 13348960310 · [email protected]
上海麦克林生化科技股份有限公司021-50706066 15221275939 · [email protected]
江苏艾康生物医药研发有限公司025-025-66113011 15955137747 · [email protected]
上海仲因实业有限公司
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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