4(3H)-Quinazolinone, 3-(4-bromophenyl)-2-ethyl-6-fluoro-
Basic information
- CAS
49579-29-5- Standard SMILES
CCc1nc2ccc(F)cc2c(=O)n1-c1ccc(Br)cc1- InChIKey
YGAPXYUPHYHIFW-UHFFFAOYSA-N- Molecular formula
- C16H12BrFN2O
- Average molar mass
- 347.18 g/mol
- Monoisotopic mass
- 346.0117
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(4-bromophenyl)-2-ethyl-6-fluoro-
- IUPAC
- 3-(4-bromophenyl)-2-ethyl-6-fluoroquinazolin-4-one
Names & synonyms
4(3H)-Quinazolinone, 3-(4-bromophenyl)-2-ethyl-6-fluoro-49579-29-5BRN 08140963-(4-Bromophenyl)-2-ethyl-6-fluoro-4(3H)-quinazolinoneDTXSID801978863-(4-Bromophenyl)-2-ethyl-6-fluoroquinazolin-4(3H)-one
Database identifiers
- CAS
49579-29-5- PubChem CID
- 63474
- DTXSID
DTXSID80197886
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 434
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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