4(3H)-Quinazolinone, 6-fluoro-3-(4-fluorophenyl)-2-(trifluoromethyl)-
Basic information
- CAS
49579-41-1- Standard SMILES
O=c1c2cc(F)ccc2nc(C(F)(F)F)n1-c1ccc(F)cc1- InChIKey
CZKKGLQTDMJFLQ-UHFFFAOYSA-N- Molecular formula
- C15H7F5N2O
- Average molar mass
- 326.22 g/mol
- Monoisotopic mass
- 326.04785366
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-fluoro-3-(4-fluorophenyl)-2-(trifluoromethyl)-
- IUPAC
- 6-fluoro-3-(4-fluorophenyl)-2-(trifluoromethyl)quinazolin-4-one
Names & synonyms
BRN 08325054(3H)-Quinazolinone, 6-fluoro-3-(4-fluorophenyl)-2-(trifluoromethyl)-49579-41-1DTXSID901978975-24-03-00177 (Beilstein Handbook Reference)6-Fluoro-3-(4-fluorophenyl)-2-(trifluoromethyl)-4(3H)-quinazolinoneRefChem:284298DTXCID501203886-Fluoro-3-(4-fluorophenyl)-2-(trifluoromethyl)quinazolin-4(3H)-one
Database identifiers
- CAS
49579-41-1- PubChem CID
- 63479
- DTXSID
DTXSID90197897
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 499
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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