Basic information
- CAS
76617-98-6- Standard SMILES
O=c1c2ccccc2nc(-c2ccccc2)n1-c1ccccc1-c1nc2ccccc2[nH]1- InChIKey
ZXQFEBYYOGMXCB-UHFFFAOYSA-N- Molecular formula
- C27H18N4O
- Average molar mass
- 414.5 g/mol
- Monoisotopic mass
- 414.14806121
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(o-(2-benzimidazolyl)phenyl)-2-phenyl-
- IUPAC
- 3-[2-(1H-benzimidazol-2-yl)phenyl]-2-phenylquinazolin-4-one
Names & synonyms
BRN 56395684(3H)-Quinazolinone, 3-(o-(2-benzimidazolyl)phenyl)-2-phenyl-76617-98-63-(o-(2-Benzimidazolyl)phenyl)-2-phenyl-4(3H)-quinazolinoneDTXSID00227432RefChem:284142DTXCID001499233-[2-(1H-1,3-Benzimidazol-2-yl)phenyl]-2-phenylquinazolin-4(3H)-one
Database identifiers
- CAS
76617-98-6- PubChem CID
- 63578
- DTXSID
DTXSID00227432- Nikkaji
- J73.042D
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 716
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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