Basic information
- CAS
49579-01-3- Standard SMILES
Cc1ccccc1-n1c(C)nc2ccc(F)cc2c1=O- InChIKey
HVIXBXRHTSCRRM-UHFFFAOYSA-N- Molecular formula
- C16H13FN2O
- Average molar mass
- 268.28 g/mol
- Monoisotopic mass
- 268.1011912
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-fluoro-2-methyl-3-(2-methylphenyl)-
- IUPAC
- 6-fluoro-2-methyl-3-(2-methylphenyl)quinazolin-4-one
Names & synonyms
49579-01-34(3H)-Quinazolinone, 6-fluoro-2-methyl-3-(2-methylphenyl)-6-Fluoro-2-methyl-3-(o-tolyl)quinazolin-4(3H)-one6-fluoro-2-methyl-3-(2-methylphenyl)-3,4-dihydroquinazolin-4-oneBRN 08879906-Fluoro-2-methyl-3-(2-methylphenyl)-4(3H)-quinazolinoneSCHEMBL6601051DTXSID10197859HVIXBXRHTSCRRM-UHFFFAOYSA-N6-fluoro-2-methyl-3-(2-methylphenyl)quinazolin-4(3H)-one6-fluoro-2-methyl-3-(2-methyl-phenyl)-3H-quinazolin-4-one
Database identifiers
- CAS
49579-01-3- PubChem CID
- 63467
- DTXSID
DTXSID10197859
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 423
Related reactions
3 records
Compound notes
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