Basic information
- Standard SMILES
O=C(NCCc1c[nH]c2ccc(C(F)(F)F)cc12)c1ccc(Cc2cccc(F)c2)cc1- InChIKey
BERQAJBMVHJFQG-UHFFFAOYSA-N- Molecular formula
- C25H20F4N2O
- Average molar mass
- 440.4 g/mol
- Monoisotopic mass
- 440.15117591
Names & identifiers
- Preferred name
- 4-(3-Fluorobenzyl)-N-(2-(5-(trifluoromethyl)-1H-indol-3-yl)ethyl)benzamide
- IUPAC
- 4-[(3-fluorophenyl)methyl]-N-[2-[5-(trifluoromethyl)-1H-indol-3-yl]ethyl]benzamide
Names & synonyms
4-(3-Fluorobenzyl)-N-(2-(5-(trifluoromethyl)-1H-indol-3-yl)ethyl)benzamideSCHEMBL9942405CHEMBL3985793BDBM207951US9266832, Cpd108
Database identifiers
- PubChem CID
- 67976706
- ChEMBL
CHEMBL3985793
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 44.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 620
Related reactions
1 records
Compound notes
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