2-(1H-Imidazol-1-yl)-3-phenyl-4(3H)-quinazolinone
Basic information
- CAS
103949-48-0- Standard SMILES
O=c1c2ccccc2nc(-n2ccnc2)n1-c1ccccc1- InChIKey
WBBCSELLZSHFNM-UHFFFAOYSA-N- Molecular formula
- C17H12N4O
- Average molar mass
- 288.3 g/mol
- Monoisotopic mass
- 288.10111102
Names & identifiers
- Preferred name
- 2-(1H-Imidazol-1-yl)-3-phenyl-4(3H)-quinazolinone
- IUPAC
- 2-imidazol-1-yl-3-phenylquinazolin-4-one
Names & synonyms
2-(1H-Imidazol-1-yl)-3-phenyl-4(3H)-quinazolinoneCHEMBL1630041SCHEMBL10516048DTXSID601232440103949-48-02-(1H-Imidazol-1-yl)-3-phenylquinazolin-4(3H)-one
Database identifiers
- CAS
103949-48-0- PubChem CID
- 21242500
- DTXSID
DTXSID601232440- ChEMBL
CHEMBL1630041
Properties
Computed structural properties
- XLogP
- 2.6
- Topological polar surface area
- 50.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 458
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Compound notes
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