Basic information
- Standard SMILES
COC(=O)C(CCCCNCc1ccc(F)c(C)c1)Nc1cc(C)c(F)c(C)c1- InChIKey
HACWZKKYHMRTLV-UHFFFAOYSA-N- Molecular formula
- C23H30F2N2O2
- Average molar mass
- 404.5 g/mol
- Monoisotopic mass
- 404.22753453
Names & identifiers
- Preferred name
- Methyl 2-(4-fluoro-3,5-dimethylanilino)-6-[(4-fluoro-3-methylphenyl)methylamino]hexanoate
- IUPAC
- methyl 2-(4-fluoro-3,5-dimethylanilino)-6-[(4-fluoro-3-methylphenyl)methylamino]hexanoate
Names & synonyms
SCHEMBL4742674
Database identifiers
- PubChem CID
- 69170369
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 50.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 11
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 481
Related reactions
1 records
Compound notes
Loading…