4(3H)-Quinazolinone, 6-bromo-3-(4-(((2-hydroxy-3-nitrophenyl)methylene)amino)phenyl)-2-methyl-
Basic information
- CAS
36933-76-3- Standard SMILES
Cc1nc2ccc(Br)cc2c(=O)n1-c1ccc(N=Cc2cccc([N+](=O)[O-])c2O)cc1- InChIKey
DOVUMDHECGRTBW-UHFFFAOYSA-N- Molecular formula
- C22H15BrN4O4
- Average molar mass
- 479.3 g/mol
- Monoisotopic mass
- 478.02767
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-bromo-3-(4-(((2-hydroxy-3-nitrophenyl)methylene)amino)phenyl)-2-methyl-
- IUPAC
- 6-bromo-3-[4-[(2-hydroxy-3-nitrophenyl)methylideneamino]phenyl]-2-methylquinazolin-4-one
Names & synonyms
BRN 08638394(3H)-Quinazolinone, 6-bromo-3-(4-(((2-hydroxy-3-nitrophenyl)methylene)amino)phenyl)-2-methyl-36933-76-3
Database identifiers
- CAS
36933-76-3- PubChem CID
- 63454
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 111 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 746
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Compound notes
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