4(3H)-Quinazolinone, 6-fluoro-2-methyl-3-(4-nitrophenyl)-
Basic information
- CAS
49579-18-2- Standard SMILES
Cc1nc2ccc(F)cc2c(=O)n1-c1ccc([N+](=O)[O-])cc1- InChIKey
JKQJYQQUAAXVQU-UHFFFAOYSA-N- Molecular formula
- C15H10FN3O3
- Average molar mass
- 299.26 g/mol
- Monoisotopic mass
- 299.07061935
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-fluoro-2-methyl-3-(4-nitrophenyl)-
- IUPAC
- 6-fluoro-2-methyl-3-(4-nitrophenyl)quinazolin-4-one
Names & synonyms
BRN 08277684(3H)-Quinazolinone, 6-fluoro-2-methyl-3-(4-nitrophenyl)-49579-18-26-Fluoro-2-methyl-3-(4-nitrophenyl)-4(3H)-quinazolinoneDTXSID701978756-Fluoro-2-methyl-3-(4-nitrophenyl)quinazolin-4(3H)-one
Database identifiers
- CAS
49579-18-2- PubChem CID
- 63783
- DTXSID
DTXSID70197875
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 78.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 1
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 497
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…