Basic information
- Standard SMILES
Cc1nc(C(C)C)c(Sc2cc(Cl)cc(Cl)c2)n1COCCOC1=CCCCCCC1- InChIKey
XPXGLUVEOYJGCU-UHFFFAOYSA-N- Molecular formula
- C24H32Cl2N2O2S
- Average molar mass
- 483.5 g/mol
- Monoisotopic mass
- 482.1561548
Names & identifiers
- Preferred name
- 1-[2-(Cycloocten-1-yloxy)ethoxymethyl]-5-(3, 5-dichlorophenylthio)-4-isopropyl-2-methyl-1H-imidazole
- IUPAC
- 1-[2-(cycloocten-1-yloxy)ethoxymethyl]-5-(3,5-dichlorophenyl)sulfanyl-2-methyl-4-propan-2-ylimidazole
Names & synonyms
SCHEMBL6160598XPXGLUVEOYJGCU-UHFFFAOYSA-N1-[2-(Cycloocten-1-yloxy)ethoxymethyl]-5-(3, 5-dichlorophenylthio)-4-isopropyl-2-methyl-1H-imidazole
Database identifiers
- PubChem CID
- 478182
Properties
Computed structural properties
- XLogP
- 7.9
- Topological polar surface area
- 61.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 9
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 556
Related reactions
2 records
Compound notes
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