Basic information
- CAS
22543-39-1- Standard SMILES
O=C1CC(Nc2ccc(F)cc2)C(=O)N1c1ccccc1- InChIKey
FYWZSTCWUDJOCD-UHFFFAOYSA-N- Molecular formula
- C16H13FN2O2
- Average molar mass
- 284.28 g/mol
- Monoisotopic mass
- 284.09610582
Names & identifiers
- Preferred name
- 3-[(4-Fluorophenyl)amino]-1-phenylpyrrolidine-2,5-dione
- IUPAC
- 3-(4-fluoroanilino)-1-phenylpyrrolidine-2,5-dione
- English name
- 3-(4-fluoroanilino)-1-phenylpyrrolidine-2,5-dione
- Molecular formula
- C16H13FN2O2
- Molecular weight
- 284.29
Names & synonyms
3-((4-fluorophenyl)amino)-1-phenylpyrrolidine-2,5-dione3-[(4-fluorophenyl)amino]-1-phenylpyrrolidine-2,5-dione3-(4-fluoroanilino)-1-phenylpyrrolidine-2,5-dioneOprea1_617258Oprea1_856133F0030-0088CHEMBL54982023-(4-Fluoro-phenylamino)-1-phenyl-pyrrolidine-2,5-dioneAKOS000525184AKOS016289791EU-0034599ST50454859
Show more names
2,5-Pyrrolidinedione, 3-[(4-fluorophenyl)amino]-1-phenyl-
SR-01000398649SR-01000398649-13-[(4-fluorophenyl)amino]-1-phenylazolidine-2,5-dione3-[(4-fluorophenyl)amino]-1-phenyl-2,5-pyrrolidinedione
Database identifiers
- CAS
22543-39-1- PubChem CID
- 2834473
- ChEMBL
CHEMBL5498202- EC Number
- 153-543-1
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 49.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 401
Physicochemical properties
- Boiling point
- 535.2 · 535.2±45.0 °C(Predicted)
- Density
- 1.379 · 1.379±0.06 g/cm3(Predicted)
- pka
- 2.34 · 2.34±0.20(Predicted)
Chemistry & industry
Suppliers2 total
西格玛奥德里奇（上海）贸易有限公司21-20338288 · [email protected]
OTAVA-BB[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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