Basic information
- Standard SMILES
CC(C(=O)NCc1ccccc1F)C(=O)NC1C(=O)N(C)c2ccccc2-c2ccccc21- InChIKey
FBBPCHXJVMRLFI-UHFFFAOYSA-N- Molecular formula
- C26H24FN3O3
- Average molar mass
- 445.5 g/mol
- Monoisotopic mass
- 445.1801698
Names & identifiers
- Preferred name
- N-(2-Fluoro-benzyl)-2-methyl-N'-(5-methyl-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl)-malonamide
- IUPAC
- N-[(2-fluorophenyl)methyl]-2-methyl-N'-(5-methyl-6-oxo-7H-benzo[d][1]benzazepin-7-yl)propanediamide
Names & synonyms
SCHEMBL1375912FBBPCHXJVMRLFI-UHFFFAOYSA-NN-(2-Fluoro-benzyl)-2-methyl-N'-(5-methyl-6-oxo-6,7-dihydro-5H-dibenzo[b,d]azepin-7-yl)-malonamide
Database identifiers
- PubChem CID
- 10095038
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 732
Related reactions
2 records
Compound notes
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