5-(4-Fluorobenzoyl)-6-methoxy-2-methylsulfonylnaphthalene
Basic information
- Standard SMILES
COc1ccc2cc(S(C)(=O)=O)ccc2c1C(=O)c1ccc(F)cc1- InChIKey
WTSMEQARCCMWGM-UHFFFAOYSA-N- Molecular formula
- C19H15FO4S
- Average molar mass
- 358.4 g/mol
- Monoisotopic mass
- 358.06750829
Names & identifiers
- Preferred name
- 5-(4-Fluorobenzoyl)-6-methoxy-2-methylsulfonylnaphthalene
- IUPAC
- (4-fluorophenyl)-(2-methoxy-6-methylsulfonylnaphthalen-1-yl)methanone
Names & synonyms
SCHEMBL7497620WTSMEQARCCMWGM-UHFFFAOYSA-N5-(4-fluorobenzoyl)-6-methoxy-2-methylsulfonylnaphthalene
Database identifiers
- PubChem CID
- 15434616
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 68.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 25
- Formal charge
- 0
- Complexity
- 577
Related reactions
3 records
Compound notes
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