Basic information
- Standard SMILES
Cn1cc(-c2nc3ccc(CC(=O)O)cc3o2)c2ccc(F)cc21- InChIKey
LYOSJCJAPNLIAA-UHFFFAOYSA-N- Molecular formula
- C18H13FN2O3
- Average molar mass
- 324.3 g/mol
Names & identifiers
- Preferred name
- (2-(6-Fluoro-1-methyl-3-indolyl)-6-benzoxazolyl)acetic acid
- IUPAC
- 2-[2-(6-fluoro-1-methylindol-3-yl)-1,3-benzoxazol-6-yl]acetic acid
Names & synonyms
SCHEMBL2433950LYOSJCJAPNLIAA-UHFFFAOYSA-N(2-(6-fluoro-1-methyl-3-indolyl)-6-benzoxazolyl)acetic acid
Database identifiers
- PubChem CID
- 17859002
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 68.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 491
Related reactions
2 records
Compound notes
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