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Sepazonium chloride

HCID 65336
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Basic information

CAS
54143-54-3
Standard SMILES
Clc1ccc(COC(C[n+]2ccn(CCc3ccccc3)c2)c2ccc(Cl)cc2Cl)c(Cl)c1.[Cl-]
InChIKey
RHEJCPIREFCJNF-UHFFFAOYSA-M
Molecular formula
C26H23Cl5N2O
Average molar mass
556.7 g/mol
Monoisotopic mass
554.025302

Names & identifiers

Preferred name
Sepazonium chloride
IUPAC
1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-3-(2-phenylethyl)imidazol-1-ium chloride
English name
sepazonium chloride
Molecular formula
C26H23Cl5N2O
Molecular weight
556.73862

Names & synonyms

Sepazonium chloride54143-54-3Chlorure de sepazoniumCloruro de sepazonioR 27,50054473012UKR-275001-(2,4-Dichloro-beta-((2,4-dichlorobenzyl)oxy)phenethyl)-3-phenethylimidazolium chlorideSepazonii chloridum1H-Imidazolium, 1-(2-(2,4-dichlorophenyl)-2-((2,4-dichlorophenyl)methoxy)ethyl)-3-(2-phenylethyl)-, chlorideSepazonii chloridum [INN-Latin]1-[2,4-Dichloro-beta-[(2,4-dichlorobenzyl)oxy]phenethyl]-3-phenethylimidazolium chloride
Show more names
Sepazonium
UNII-54473012UKCloruro de sepazonio [INN-Spanish]EINECS 258-995-4Chlorure de sepazonium [INN-French]Sepazonium chloride [USAN:INN:BAN]R 27500SCHEMBL347058CHEMBL2107473

Database identifiers

CAS
54143-54-3
PubChem CID
65336
DTXSID
DTXSID30969055
ChEMBL
CHEMBL2107473
UNII
54473012UK
EC Number
258-995-4

Properties

Computed structural properties

Topological polar surface area
18 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
9
Heavy atoms
34
Formal charge
0
Complexity
578

Physicochemical properties

FDA UNII
54473012 UK · 54473012UK

Chemistry & industry

Applications

UsesAnti-infective, topical.

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Related reactions

2 records
New reaction record
HRID 328649 reaction equation
HRID 328649As productuspto-grants-1977_04
HRID 1730219 reaction equation
HRID 1730219As productuspto-grants-1976_11

Compound notes

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