Basic information
- Standard SMILES
COc1cc(C(C)(C)c2cnc(S)n2-c2ccc(F)cc2)ccc1Cl- InChIKey
UNZRTUAHVJDZLF-UHFFFAOYSA-N- Molecular formula
- C19H18ClFN2OS
- Average molar mass
- 376.9 g/mol
- Monoisotopic mass
- 376.0812402
Names & identifiers
- Preferred name
- 5-(2-(4-chloro-3-methoxyphenyl)propan-2-yl)-1-(4-fluorophenyl)-1H-imidazole-2-thiol
- IUPAC
- 4-[2-(4-chloro-3-methoxyphenyl)propan-2-yl]-3-(4-fluorophenyl)-1H-imidazole-2-thione
Database identifiers
- PubChem CID
- 66740500
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 56.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 534
Related reactions
14 records
Compound notes
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