Basic information
- Standard SMILES
CC(NC(=O)c1c(F)c(F)c(N)c(F)c1F)C(=O)N1CCCC1C(=O)NC1CC(=O)OC1OCc1ccccc1- InChIKey
SEDJSTCXEPLLPQ-UHFFFAOYSA-N- Molecular formula
- C26H26F4N4O6
- Average molar mass
- 566.5 g/mol
Names & identifiers
- Preferred name
- 1-[2-(4-Amino-2,3,5,6-tetrafluoro-benzoylamino)-propionyl]-pyrrolidine-2-carboxylic acid (2-benzyloxy-5-oxo-tetrahydro-furan-3-yl)-amide
- IUPAC
- 1-[2-[(4-amino-2,3,5,6-tetrafluorobenzoyl)amino]propanoyl]-N-(5-oxo-2-phenylmethoxyoxolan-3-yl)pyrrolidine-2-carboxamide
Names & synonyms
SEDJSTCXEPLLPQ-UHFFFAOYSA-N1-[2-(4-amino-2,3,5,6-tetrafluoro-benzoylamino)-propionyl]-pyrrolidine-2-carboxylic acid (2-benzyloxy-5-oxo-tetrahydro-furan-3-yl)-amide
Database identifiers
- PubChem CID
- 22977489
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 140 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 8
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 940
Related reactions
4 records
Compound notes
Loading…