Basic information
- Standard SMILES
CN(C)CC(CC(=O)OCc1ccccc1)NC(=O)CCCCCCCOCc1cc(F)ccc1F- InChIKey
IAOLTHBWJYKRSE-UHFFFAOYSA-N- Molecular formula
- C28H38F2N2O4
- Average molar mass
- 504.6 g/mol
Names & identifiers
- Preferred name
- Benzyl 3-[8-[(2,5-difluorophenyl)methoxy]octanoylamino]-4-(dimethylamino)butanoate
- IUPAC
- benzyl 3-[8-[(2,5-difluorophenyl)methoxy]octanoylamino]-4-(dimethylamino)butanoate
Names & synonyms
SCHEMBL1007337
Database identifiers
- PubChem CID
- 66874751
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 67.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 18
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 616
Related reactions
1 records
Compound notes
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