3-(4-Fluorophenyl)-2-methyl-4(3H)-quinazolinone
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Basic information
- CAS
1897-80-9- Standard SMILES
Cc1nc2ccccc2c(=O)n1-c1ccc(F)cc1- InChIKey
RONAQXGMJDYSJD-UHFFFAOYSA-N- Molecular formula
- C15H11FN2O
- Average molar mass
- 254.26 g/mol
- Monoisotopic mass
- 254.08554114
Names & identifiers
- Preferred name
- 3-(4-Fluorophenyl)-2-methyl-4(3H)-quinazolinone
- IUPAC
- 3-(4-fluorophenyl)-2-methylquinazolin-4-one
- English name
- 3-(p-fluorophenyl)-2-methyl-4(3h)-quinazolinon
- Molecular formula
- C15H11FN2O
- Molecular weight
- 254.26
Names & synonyms
1897-80-94(3H)-Quinazolinone, 3-(p-fluorophenyl)-2-methyl-3-(4-fluorophenyl)-2-methyl-4(3H)-quinazolinoneDTXSID70172389RefChem:1066850DTXCID30948803-(4-fluorophenyl)-2-methylquinazolin-4(3H)-one3-(4-fluorophenyl)-2-methylquinazolin-4-oneWAY-6222524(3H)-Quinazolinone, 3-(4-fluorophenyl)-2-methyl-3-(4-fluorophenyl)-2-methyl-3,4-dihydroquinazolin-4-one3-(p-fluorophenyl)-2-methyl-4(3h)-quinazolinon
Show more names
2-methyl-3-(4’-fluorphenyl)chinazolon-(4)3-(4-fluorophenyl)-2-methyl-quinazolin-4-one
3-(4-Fluorophenyl)-2-Methyl-4(3H)-QuinazolinonMLS000112635SMR000108546B 228BRN 08865662-Methyl-3-(p-fluorophenyl)-4(3H)-quinazolinone3-(4-Fluoro-phenyl)-2-methyl-3H-quinazolin-4-one2-Methyl-3-(4'-fluorphenyl)chinazolon-(4) [German]
Database identifiers
- CAS
1897-80-9- PubChem CID
- 63367
- DTXSID
DTXSID70172389- ChEMBL
CHEMBL1577468- Nikkaji
- J73.087D
Properties
Computed structural propertiesFilling in
- XLogP
- 2.2
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 388
Physicochemical properties
- Melting point
- 132 · 132-134 °C
- Boiling point
- 411.4 · 411.4±47.0 °C(Predicted)
- Density
- 1.25 · 1.25±0.1 g/cm3(Predicted)
- form
- Solid
- pka
- 2.89 · 2.89±0.70(Predicted)
- color
- White to off-white
Chemistry & industry
Applications
UsesWAY-622252 is an active molecule for the study of amyloid diseases and synucleinopathies.
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
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Compound notes
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