Basic information
- Standard SMILES
CC(=O)c1ccc(S(=O)(=O)N2CCCC2c2ccc(F)cc2)cc1- InChIKey
VUUAXRVVHDRSNX-UHFFFAOYSA-N- Molecular formula
- C18H18FNO3S
- Average molar mass
- 347.4 g/mol
- Monoisotopic mass
- 347.09914277
Names & identifiers
- Preferred name
- (RS)-1-{4-[2-(4-Fluoro-phenyl)-pyrrolidine-1-sulfonyl]-phenyl}-ethanone
- IUPAC
- 1-[4-[2-(4-fluorophenyl)pyrrolidin-1-yl]sulfonylphenyl]ethanone
Names & synonyms
SCHEMBL6180100VUUAXRVVHDRSNX-UHFFFAOYSA-N(RS)-1-{4-[2-(4-Fluoro-phenyl)-pyrrolidine-1- sulfonyl]-phenyl}-ethanone
Database identifiers
- PubChem CID
- 21706702
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 543
Related reactions
2 records
Compound notes
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