Stilonium Iodide
Basic information
- CAS
2551-76-0- Standard SMILES
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2ccccc2)cc1.[I-]- InChIKey
RDTKUZXIHMTSJO-UEIGIMKUSA-M- Molecular formula
- C22H30INO
- Average molar mass
- 451.4 g/mol
- Monoisotopic mass
- 451.13721
Names & identifiers
- Preferred name
- Stilonium Iodide
- IUPAC
- triethyl-[2-[4-[(E)-2-phenylethenyl]phenoxy]ethyl]azanium iodide
- English name
- MG 624
- Molecular formula
- C22H30INO
- Molecular weight
- 451.38
Names & synonyms
Stilonium iodide77257-42-2ElvetilIodure de stiloniumIoduro de estilonioMG-624Stilonio ioduroStilonii iodidumDTXSID2045781M.G. 62419B3530KQ6DTXCID0025781
Show more names
StiloniumMG 624, alpha7 nACh receptor antagonistN,N,N-TRIETHYL-2-(4-TRANS-STILBENOXY)ETHYLAMMONIUM IODIDEN,N,N-TRIETHYL-2-[4-(2-PHENYLETHENYL)PHENOXY]ETHANAMINIUM IODIDE
RefChem:1099076MG 624MG6242551-76-0(E)-N,N,N-Triethyl-2-(4-styrylphenoxy)ethan-1-aminium iodidetriethyl-[2-[4-[(E)-2-phenylethenyl]phenoxy]ethyl]azanium;iodideStilonio ioduro [DCIT]MLS002172460
Database identifiers
- CAS
2551-76-0、77257-42-2- PubChem CID
- 6433339
- DTXSID
DTXSID2045781- ChEMBL
CHEMBL1257065- UNII
- 19B3530KQ6
Properties
Computed structural properties
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 9
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 339
Physicochemical properties
- Melting point
- 211 · 211-212 °C
- storage temp.
- Store at RT
- solubility
- 22 mg/mL · DMSO: ≤22 mg/mL
- form
- Powder
- color
- White to off-white
- InChI
- 1S/C22H30NO.HI/c1-4-23(5-2,6-3)18-19-24-22-16-14-21(15-17-22)13-12-20-10-8-7-9-11-20;/h7-17H,4-6,18-19H2,1-3H3;1H/q+1;/p-1/b13-12+;
- InChIKey
- RDTKUZXIHMTSJO-UEIGIMKUSA-M
- SMILES
- [I-].CC[N+](CC)(CC)CCOc1ccc(cc1)\C=C\c2ccccc2
- FDA UNII
- 19 B3530KQ6 · 19B3530KQ6
- UNSPSC Code
- 12352200 · 12352200
- NACRES
- 77 · NA.77
- PPE
- 95 · Eyeshields, Gloves, type N95 (US)
- WGK Germany
- 3 · 3
- RTECS
- 4305000 · BS4305000
- Storage Class
- 11 · 11 - Combustible Solids
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
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- rtecs
- BS4305000
- Storage Class
- 11 - Combustible Solids
Chemistry & industry
Applications
UsesAntispasmodic.
UsesMG 624 is an antagonist of neuronal AChR.
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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