Basic information
- CAS
153-76-4- Standard SMILES
CCN(CC)CCOc1cccc(OCCN(CC)CC)c1OCCN(CC)CC- InChIKey
ICLWTJIMXVISSR-UHFFFAOYSA-N- Molecular formula
- C24H45N3O3
- Average molar mass
- 423.6 g/mol
- Monoisotopic mass
- 423.34609231
Overview
Gallamine is a tertiary amine non-depolarising muscle relaxant whose structure comprises a core benzene molecule substituted at each of C-1, C-2 and C-3 by an N,N-diethyl-2-(ethylamino)ethoxy group. It has a role as a cholinergic antagonist, a muscle relaxant and a drug allergen.
Names & identifiers
- Preferred name
- Gallamine
- IUPAC
- 2-[2,3-bis[2-(diethylamino)ethoxy]phenoxy]-N,N-diethylethanamine
- English name
- 2,2',2''-[benzene-1,2,3-triyltri(oxy)]tris[N,N-diethylethylamine]
- Molecular formula
- C24H45N3O3
- Molecular weight
- 423.6324
Names & synonyms
Gallamonum153-76-41146X1WTNM2,2',2''-(Benzene-1,2,3-triyltri(oxy))tris(N,N-diethylethylamine)CHEBI:503442DTXSID601651842,2',2''-[benzene-1,2,3-triyltris(oxy)]tris(N,N-diethylethanamine)2,2',2''-(benzene-1,2,3-triyltris(oxy))tris(N,N-diethylethanamine)RefChem:634082DTXCID3087675205-816-22-(2,6-bis(2-triethylazaniumylethoxy)phenoxy)ethyl-triethylazanium
Show more names
2,2',2''-(1,2,3-Benzenetriyltrisoxy)tris(N,N-diethylethanamine)2-[2,6-bis(2-diethylaMinoethyloxy)phenoxy]-N,N-diethylethanaMine2,2',2''-[1,2,3-Benzenetriyltris(oxy)]tris[N,N-diethylethanamine]2,2',2''-[benzene-1,2,3-triyltri(oxy)]tris[N,N-diethylethylamine]Ethanamine, 2,2',2''-[1,2,3-benzenetriyltris(oxy)]tris[N,N-diethyl-
gallamine2-(2,6-bis(2-(diethylamino)ethoxy)phenoxy)-N,N-diethylethanamineGallamine [BAN]EINECS 205-816-2UNII-1146X1WTNMEpitope ID:120372GALLAMINE [WHO-DD]SCHEMBL2138
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 37.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 18
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 362
Physicochemical properties
- FDA UNII
- 1146 X1WTNM · 1146X1WTNM
Chemistry & industry
Pharmacology
ATC Code
M - Musculo-skeletal system
QM - Musculo-skeletal system
MeSH Pharmacological Classification
Drugs that interrupt transmission at the skeletal neuromuscular junction without causing depolarization of the motor end plate. They prevent acetylcholine from triggering muscle contraction and are used as muscle relaxants during electroshock treatments, in convulsive states, and as anesthesia adjuvants.
Drugs that bind to nicotinic cholinergic receptors (RECEPTORS, NICOTINIC) and block the actions of acetylcholine or cholinergic agonists. Nicotinic antagonists block synaptic transmission at autonomic ganglia, the skeletal neuromuscular junction, and at central nervous system nicotinic synapses.
Applications
UsesNeuromuscular blocking agent.
Suppliers3 total
Alfa Chemistry+1-5166625404 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Additional notes
DefinitionChEBI: A tertiary amine non-depolarising muscle relaxant whose structure comprises a core benzene molecule substituted at each of C-1, C-2 and C-3 by an N,N-diethyl-2-(ethylamino)ethoxy group.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…