4(3H)-Quinazolinone, 3-((((4-chlorophenyl)azo)(4-(dimethylamino)phenyl)methylene)amino)-2-ethyl-
Basic information
- CAS
110605-12-4- Standard SMILES
CCc1nc2ccccc2c(=O)n1/N=C(\N=Nc1ccc(Cl)cc1)c1ccc(N(C)C)cc1- InChIKey
CKWUIGZKSXOBKG-CBTWDDLFSA-N- Molecular formula
- C25H23ClN6O
- Average molar mass
- 458.9 g/mol
- Monoisotopic mass
- 458.1621871
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-((((4-chlorophenyl)azo)(4-(dimethylamino)phenyl)methylene)amino)-2-ethyl-
- IUPAC
- N-(4-chlorophenyl)imino-4-(dimethylamino)-N'-(2-ethyl-4-oxoquinazolin-3-yl)benzenecarboximidamide
Names & synonyms
BRN 5173724NSC6223614(3H)-Quinazolinone, 3-((((4-chlorophenyl)azo)(4-(dimethylamino)phenyl)methylene)amino)-2-ethyl-CHEMBL1969861NSC-622361110605-12-4
Database identifiers
- CAS
110605-12-4- PubChem CID
- 9569853
- ChEMBL
CHEMBL1969861
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 73 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 765
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Compound notes
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