Basic information
- Standard SMILES
Cc1[nH]c2cc(F)ccc2c1Sc1cccc(CC(=O)O)c1- InChIKey
FMPIUFURGNDFTA-UHFFFAOYSA-N- Molecular formula
- C17H14FNO2S
- Average molar mass
- 315.4 g/mol
Names & identifiers
- Preferred name
- [3-(6-Fluoro-2-methyl-1H-indol-3-ylsulfanyl)-phenyl]-acetic acid
- IUPAC
- 2-[3-[(6-fluoro-2-methyl-1H-indol-3-yl)sulfanyl]phenyl]acetic acid
Names & synonyms
SCHEMBL670395FMPIUFURGNDFTA-UHFFFAOYSA-N[3-(6-Fluoro-2-methyl-1H-indol-3-ylsulfanyl)-phenyl]-acetic acid
Database identifiers
- PubChem CID
- 56840409
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 78.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 408
Related reactions
1 records
Compound notes
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