3-[(4-Fluorophenyl)methyl]-5-[[4-[(4-methylphenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione
Basic information
- CAS
433930-01-9- Standard SMILES
Cc1ccc(COc2ccc(C=C3SC(=O)N(Cc4ccc(F)cc4)C3=O)cc2)cc1- InChIKey
LZPUZKWXXFCLEO-UHFFFAOYSA-N- Molecular formula
- C25H20FNO3S
- Average molar mass
- 433.5 g/mol
Names & identifiers
- Preferred name
- 3-[(4-Fluorophenyl)methyl]-5-[[4-[(4-methylphenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione
- IUPAC
- 3-[(4-fluorophenyl)methyl]-5-[[4-[(4-methylphenyl)methoxy]phenyl]methylidene]-1,3-thiazolidine-2,4-dione
- English name
- 3-(4-fluorobenzyl)-5-{4-[(4-methylbenzyl)oxy]benzylidene}-1,3-thiazolidine-2,4-dione
- Molecular formula
- C25H20FNO3S
- Molecular weight
- 433.5
Names & synonyms
3-(4-fluorobenzyl)-5-{4-[(4-methylbenzyl)oxy]benzylidene}-1,3-thiazolidine-2,4-dione
Database identifiers
- CAS
433930-01-9
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 71.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 660
Physicochemical properties
- Boiling point
- 607.264 · 607.264±65.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.34 · 1.340±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- pka
- -2.636 · -2.636±0.20(predicted)
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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