Basic information
- Standard SMILES
CSc1ccc(C(O)c2ccccc2OCc2ccccc2)cc1- InChIKey
ZQPADAPCRIOKEM-UHFFFAOYSA-N- Molecular formula
- C21H20O2S
- Average molar mass
- 336.4 g/mol
Names & identifiers
- Preferred name
- (2-Benzyloxyphenyl)-(4-methylsulfanyl-phenyl)methanol
- IUPAC
- (4-methylsulfanylphenyl)-(2-phenylmethoxyphenyl)methanol
Names & synonyms
SCHEMBL2577600ZQPADAPCRIOKEM-UHFFFAOYSA-N(2-Benzyloxyphenyl)-(4-methylsulfanyl-phenyl)methanol(2-benzyloxy-phenyl)-(4-methylsulfanylphenyl)-methanol
Database identifiers
- PubChem CID
- 67459728
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 54.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 348
Related reactions
6 records
Compound notes
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