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3-(((2-Chlorophenyl)((2-chlorophenyl)azo)methylene)amino)-2-methyl-4(3H)-quinazolinone

HCID 9569846
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Basic information

CAS
110605-07-7
Standard SMILES
Cc1nc2ccccc2c(=O)n1/N=C(\N=Nc1ccccc1Cl)c1ccccc1Cl
InChIKey
PFEICYROMYNSQH-PARUYMKBSA-N
Molecular formula
C22H15Cl2N5O
Average molar mass
436.3 g/mol
Monoisotopic mass
435.0653655

Names & identifiers

Preferred name
3-(((2-Chlorophenyl)((2-chlorophenyl)azo)methylene)amino)-2-methyl-4(3H)-quinazolinone
IUPAC
2-chloro-N-(2-chlorophenyl)imino-N'-(2-methyl-4-oxoquinazolin-3-yl)benzenecarboximidamide

Names & synonyms

NSC6223543-(((2-Chlorophenyl)((2-chlorophenyl)azo)methylene)amino)-2-methyl-4(3H)-quinazolinone4(3H)-Quinazolinone, 3-(((2-chlorophenyl)((2-chlorophenyl)azo)methylene)amino)-2-methyl-o-Chloro-alpha-(2-chlorophenylazo)-N-2-methyl-4(3H)-oxo-3-quinazolinylbenzylidenimine110605-07-7CHEMBL1978292NSC-622354

Database identifiers

CAS
110605-07-7
PubChem CID
9569846
ChEMBL
CHEMBL1978292

Properties

Computed structural properties

XLogP
6
Topological polar surface area
69.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
4
Heavy atoms
30
Formal charge
0
Complexity
724

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Compound notes

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