Basic information
- Standard SMILES
Nc1ccc(F)cc1C(=O)NCCCCCCCC(=O)O- InChIKey
YLPBGKGOGSFWDC-UHFFFAOYSA-N- Molecular formula
- C15H21FN2O3
- Average molar mass
- 296.34 g/mol
- Monoisotopic mass
- 296.1536207
Names & identifiers
- Preferred name
- N-(2-amino-5-fluorobenzoyl)-8-aminocaprylic acid
- IUPAC
- 8-[(2-amino-5-fluorobenzoyl)amino]octanoic acid
Names & synonyms
SCHEMBL7743414YLPBGKGOGSFWDC-UHFFFAOYSA-NN-(2-amino-5-fluorobenzoyl) -8-aminocaprylic acid
Database identifiers
- PubChem CID
- 54514696
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 92.4 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 339
Related reactions
1 records
Compound notes
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