Basic information
- Standard SMILES
CC(C)c1nc(CCOC2=CCCCCCC2)n(C)c1Sc1cc(Cl)cc(Cl)c1- InChIKey
BXZRJTMJNXEIRC-UHFFFAOYSA-N- Molecular formula
- C23H30Cl2N2OS
- Average molar mass
- 453.5 g/mol
Names & identifiers
- Preferred name
- 2-[2-(Cycloocten-1-yloxy)ethyl]-5-(3,5-dichlorophenylthio)-4-isopropyl-1-methyl-1H-imidazole
- IUPAC
- 2-[2-(cycloocten-1-yloxy)ethyl]-5-(3,5-dichlorophenyl)sulfanyl-1-methyl-4-propan-2-ylimidazole
Names & synonyms
SCHEMBL6160531BXZRJTMJNXEIRC-UHFFFAOYSA-N2-[2-(Cycloocten-1-yloxy)ethyl]-5-(3,5-dichlorophenylthio)-4-isopropyl-1-methyl-1H-imidazole
Database identifiers
- PubChem CID
- 53707205
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 52.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 523
Related reactions
2 records
Compound notes
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