Basic information
- Standard SMILES
O=C(O)c1cc(C=C(Cn2ccnc2)c2ccc(F)cc2)ccc1CCc1ccc(F)cc1- InChIKey
UVSPXNXBPCTPTN-UHFFFAOYSA-N- Molecular formula
- C27H22F2N2O2
- Average molar mass
- 444.5 g/mol
Names & identifiers
- Preferred name
- 2-[2-(4-Fluorophenyl)ethyl]-5-[2-(4-fluorophenyl)-3-imidazol-1-ylprop-1-enyl]benzoic acid
- IUPAC
- 2-[2-(4-fluorophenyl)ethyl]-5-[2-(4-fluorophenyl)-3-imidazol-1-ylprop-1-enyl]benzoic acid
Names & synonyms
SCHEMBL7703282
Database identifiers
- PubChem CID
- 54374779
Properties
Computed structural properties
- XLogP
- 6.1
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 657
Related reactions
1 records
Compound notes
Loading…