Basic information
- Standard SMILES
CC(C)c1nc(-c2ccc(F)cc2)c(-c2ccc(F)cc2)n1/C=C/[C@@H](O)CC(=O)O[C@@H](c1ccccc1)C(O)(c1ccccc1)c1ccccc1- InChIKey
NYVLLOKQVMVSLK-KRFJCIQISA-N- Molecular formula
- C43H38F2N2O4
- Average molar mass
- 684.8 g/mol
Names & identifiers
- Preferred name
- (S)-1-hydroxy-1,1,2-triphenyleth-2-yl (3S,E)-5-[4,5-bis(4-fluorophenyl)-2-(1-methylethyl)-1H-imidazol-1-yl]-3-hydroxy-4-pentenoate
- IUPAC
- [(1S)-2-hydroxy-1,2,2-triphenylethyl] (E,3S)-5-[4,5-bis(4-fluorophenyl)-2-propan-2-ylimidazol-1-yl]-3-hydroxypent-4-enoate
Names & synonyms
SCHEMBL9784255NYVLLOKQVMVSLK-KRFJCIQISA-N(S)-1-hydroxy-1,1,2-triphenyleth-2-yl (3S,E)-5-[4,5-bis(4-fluorophenyl)-2-(1-methylethyl)-1H-imidazol-1-yl]-3-hydroxy-4-pentenoate(S)-1-Hydroxy-1,1,2-triphenyleth-2-yl(3S,E)-5-[4,5-bis(4-fluorophenyl)-2-(1-methylethyl)-1H-imidazol-1-yl]-3-hydroxy-4-pentenoate
Database identifiers
- PubChem CID
- 14849798
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 84.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 13
- Heavy atoms
- 51
- Formal charge
- 0
- Complexity
- 1,070
Related reactions
4 records
Compound notes
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