Basic information
- CAS
82256-09-5- Standard SMILES
Cc1ccc(-c2nc3ccc(Cl)cc3c(=O)[nH]2)cc1- InChIKey
PMTSKWDXZKEUDY-UHFFFAOYSA-N- Molecular formula
- C15H11ClN2O
- Average molar mass
- 270.71 g/mol
- Monoisotopic mass
- 270.0559907
Names & identifiers
- Preferred name
- 6-Chloro-2-(p-tolyl)quinazolin-4(1H)-one
- IUPAC
- 6-chloro-2-(4-methylphenyl)-3H-quinazolin-4-one
Names & synonyms
6-Chloro-2-(p-tolyl)quinazolin-4(1H)-one82256-09-56-chloro-2-(4-methylphenyl)-1,4-dihydroquinazolin-4-oneCHEMBL1241283SCHEMBL11081936DTXSID104477856-chloro-2-(4-methylphenyl)-3H-quinazolin-4-one6-Chloro-2-(4-methylphenyl)quinazolin-4(1H)-one
Database identifiers
- CAS
82256-09-5- PubChem CID
- 135405171
- DTXSID
DTXSID10447785- ChEMBL
CHEMBL1241283- Nikkaji
- J921.782G
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 388
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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