Basic information
- Standard SMILES
O=C(Nc1ccc(N2CCNCC2)cc1)c1ccccc1-c1ccc(C(F)(F)F)cc1- InChIKey
ZRHILEJKHSRERZ-UHFFFAOYSA-N- Molecular formula
- C24H22F3N3O
- Average molar mass
- 425.4 g/mol
- Monoisotopic mass
- 425.17149682
Names & identifiers
- Preferred name
- 4'-Trifluoromethyl-biphenyl-2-carboxylic acid [4-(piperazinyl)-phenyl]-amide
- IUPAC
- N-(4-piperazin-1-ylphenyl)-2-[4-(trifluoromethyl)phenyl]benzamide
Names & synonyms
4'-trifluoromethyl-biphenyl-2-carboxylic acid [4-(piperazinyl)-phenyl]-amideSCHEMBL25825284'-Trifluoromethyl-biphenyl-2-carboxylic acid (4-piperazin-1-yl-phenyl)-amideN-[4-(1-piperazinyl)phenyl]-4'-(trifluoromethyl)-[1,1'-biphenyl]-2-carboxamide
Database identifiers
- PubChem CID
- 11201099
Properties
Computed structural properties
- XLogP
- 4.7
- Topological polar surface area
- 44.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 577
Related reactions
27 records
Compound notes
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