(4-Oxo-2-phenylquinazolin-3-yl) 3-bromobenzoate
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Basic information
- CAS
331967-27-2- Standard SMILES
O=C(On1c(-c2ccccc2)nc2ccccc2c1=O)c1cccc(Br)c1- InChIKey
NTFVQOAUIXUYDD-UHFFFAOYSA-N- Molecular formula
- C21H13BrN2O3
- Average molar mass
- 421.2 g/mol
- Monoisotopic mass
- 420.01095
Names & identifiers
- Preferred name
- (4-Oxo-2-phenylquinazolin-3-yl) 3-bromobenzoate
- IUPAC
- (4-oxo-2-phenylquinazolin-3-yl) 3-bromobenzoate
- English name
- 3-[(3-bromobenzoyl)oxy]-2-phenyl-4(3H)-quinazolinone
- Molecular formula
- C21H13BrN2O3
- Molecular weight
- 421.24352
Names & synonyms
(4-oxo-2-phenyl-quinazolin-3-yl) 3-bromobenzoate(4-oxo-2-phenylquinazolin-3-yl) 3-bromobenzoateOprea1_617695Oprea1_866951SCHEMBL27935373AE-848/370183083-[(3-bromobenzoyl)oxy]-2-phenyl-4(3H)-quinazolinone
Database identifiers
- CAS
331967-27-2- PubChem CID
- 1091296
Properties
Computed structural propertiesFilling in
- XLogP
- 5
- Topological polar surface area
- 59 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 602
Related reactions
0 records
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Compound notes
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