Basic information
- Standard SMILES
Cn1c(-c2ccc(Cl)cc2)cnc1SCC1(CO)CCC1- InChIKey
AKVPBZQGHMXFOZ-UHFFFAOYSA-N- Molecular formula
- C16H19ClN2OS
- Average molar mass
- 322.9 g/mol
Names & identifiers
- Preferred name
- [1-({[5-(4-chlorophenyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}methyl)cyclobutyl]methanol
- IUPAC
- [1-[[5-(4-chlorophenyl)-1-methylimidazol-2-yl]sulfanylmethyl]cyclobutyl]methanol
Names & synonyms
SCHEMBL4897117AKVPBZQGHMXFOZ-UHFFFAOYSA-N[1-({[5-(4-chlorophenyl)-1-methyl-1H-imidazol-2-yl]sulfanyl}methyl)cyclobutyl]methanol
Database identifiers
- PubChem CID
- 11186355
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 345
Related reactions
2 records
Compound notes
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