Basic information
- Standard SMILES
CS(=O)(=O)c1ccc2c(c1)cc(CO)n2Cc1ccc(F)cc1- InChIKey
ZAVLYVOZCLXRGH-UHFFFAOYSA-N- Molecular formula
- C17H16FNO3S
- Average molar mass
- 333.4 g/mol
Names & identifiers
- Preferred name
- (1-(4-Fluorobenzyl)-5-methanesulfonylindol-2-yl)-methanol
- IUPAC
- [1-[(4-fluorophenyl)methyl]-5-methylsulfonylindol-2-yl]methanol
Names & synonyms
SCHEMBL2929127ZAVLYVOZCLXRGH-UHFFFAOYSA-N(1-(4-fluorobenzyl)-5-methanesulfonylindol-2-yl)-methanol
Database identifiers
- PubChem CID
- 22504394
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 67.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 498
Related reactions
7 records
Compound notes
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