Basic information
- Standard SMILES
CNC(=O)c1c(-c2ccc(F)cc2)oc2ccc(-c3cccc(C(=O)O)c3)nc12- InChIKey
OKTKGPLVJYDYLS-UHFFFAOYSA-N- Molecular formula
- C22H15FN2O4
- Average molar mass
- 390.4 g/mol
- Monoisotopic mass
- 390.10158513
Names & identifiers
- Preferred name
- 3-(2-(4-Fluorophenyl)-3-(methylcarbamoyl)furo[3,2-b]pyridin-5-yl)benzoic acid
- IUPAC
- 3-[2-(4-fluorophenyl)-3-(methylcarbamoyl)furo[3,2-b]pyridin-5-yl]benzoic acid
Names & synonyms
SCHEMBL2431373OKTKGPLVJYDYLS-UHFFFAOYSA-N3-(2-(4-fluorophenyl)-3-(methylcarbamoyl)furo[3,2-b]pyridin-5-yl)benzoic acid
Database identifiers
- PubChem CID
- 67405154
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 610
Related reactions
4 records
Compound notes
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