4(3H)-Quinazolinone, 3-(4-(((3,5-dichloro-2-hydroxyphenyl)methylene)amino)phenyl)-6-iodo-2-methyl-
Basic information
- CAS
36933-80-9- Standard SMILES
Cc1nc2ccc(I)cc2c(=O)n1-c1ccc(N=Cc2cc(Cl)cc(Cl)c2O)cc1- InChIKey
KXIKFNLAJWVGHP-UHFFFAOYSA-N- Molecular formula
- C22H14Cl2IN3O2
- Average molar mass
- 550.2 g/mol
- Monoisotopic mass
- 548.95078
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(4-(((3,5-dichloro-2-hydroxyphenyl)methylene)amino)phenyl)-6-iodo-2-methyl-
- IUPAC
- 3-[4-[(3,5-dichloro-2-hydroxyphenyl)methylideneamino]phenyl]-6-iodo-2-methylquinazolin-4-one
Names & synonyms
BRN 08594534(3H)-Quinazolinone, 3-(4-(((3,5-dichloro-2-hydroxyphenyl)methylene)amino)phenyl)-6-iodo-2-methyl-36933-80-9
Database identifiers
- CAS
36933-80-9- PubChem CID
- 63456
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 65.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 698
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Compound notes
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