Completing data — usually done within a minute
Basic information
- CAS
52341-68-1- Standard SMILES
Clc1ccc(COC(C[n+]2ccn(CCc3ccccc3)c2)c2ccc(Cl)cc2Cl)c(Cl)c1- InChIKey
SOHMGPGPUDLRGF-UHFFFAOYSA-N- Molecular formula
- C26H23Cl4N2O+
- Average molar mass
- 521.3 g/mol
- Monoisotopic mass
- 519.056449
Names & identifiers
- Preferred name
- Sepazonium
- IUPAC
- 1-[2-(2,4-dichlorophenyl)-2-[(2,4-dichlorophenyl)methoxy]ethyl]-3-(2-phenylethyl)imidazol-1-ium
Names & synonyms
SepazoniumSepazonium ionSepazonium [WHO-DD]Sepazonium cationUNII-6CL11JRQ166CL11JRQ1652341-68-11-(2,4-Dichloro-b-((2,4-dichlorobenzyl)oxy)phenethyl)-3-phenethylimidazolium1H-Imidazolium, 1-(2-(2,4-dichlorophenyl)-2-((2,4-dichlorophenyl)methoxy)ethyl)-3-(2-phenylethyl)-RefChem:182417CHEMBL2111126SCHEMBL29383774
Show more names
Q27264485
Database identifiers
- CAS
52341-68-1- PubChem CID
- 65337
- ChEMBL
CHEMBL2111126- UNII
- 6CL11JRQ16
- Nikkaji
- J239.376J
Properties
Computed structural propertiesFilling in
- XLogP
- 7.4
- Topological polar surface area
- 18 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 9
- Heavy atoms
- 33
- Formal charge
- 1
- Complexity
- 578
Related reactions
1 records
Compound notes
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