Basic information
- Standard SMILES
Cc1cccc(C(=O)NCc2ccc(CNC(=O)c3cccnc3Oc3ccc(F)cc3)cc2)c1O- InChIKey
SEQNJEWIPZQXAG-UHFFFAOYSA-N- Molecular formula
- C28H24FN3O4
- Average molar mass
- 485.5 g/mol
- Monoisotopic mass
- 485.17508442
Names & identifiers
- Preferred name
- 2-(4-fluoro-phenoxy)-N-{4-[(2-hydroxy-3-methyl-benzoylamino)-methyl]-benzyl}-nicotinamide
- IUPAC
- 2-(4-fluorophenoxy)-N-[[4-[[(2-hydroxy-3-methylbenzoyl)amino]methyl]phenyl]methyl]pyridine-3-carboxamide
Names & synonyms
SCHEMBL4455558SEQNJEWIPZQXAG-UHFFFAOYSA-N2-(4-fluoro-phenoxy)-N-{4-[(2-hydroxy-3-methyl-benzoylamino)-methyl]-benzyl}-nicotinamide
Database identifiers
- PubChem CID
- 9869987
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 101 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 709
Related reactions
1 records
Compound notes
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