Basic information
- Standard SMILES
O=C(O)c1ccc(CNC(=O)c2cc(F)cnc2Oc2ccc(F)cc2)cc1- InChIKey
MKVAIHBXTDOGGX-UHFFFAOYSA-N- Molecular formula
- C20H14F2N2O4
- Average molar mass
- 384.3 g/mol
- Monoisotopic mass
- 384.09216326
Names & identifiers
- Preferred name
- 4-[({[5-Fluoro-2-(4-fluorophenoxy)pyridin-3-YL]carbonyl}amino)methyl]benzoic acid
- IUPAC
- 4-[[[5-fluoro-2-(4-fluorophenoxy)pyridine-3-carbonyl]amino]methyl]benzoic acid
Names & synonyms
CHEMBL4103046SCHEMBL4450937MKVAIHBXTDOGGX-UHFFFAOYSA-NBDBM502325464-[({[5-FLUORO-2-(4-FLUOROPHENOXY)PYRIDIN-3-YL]CARBONYL}AMINO)METHYL]BENZOIC ACID
Database identifiers
- PubChem CID
- 58905358
- ChEMBL
CHEMBL4103046
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 88.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 534
Related reactions
2 records
Compound notes
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