4(3H)-Quinazolinone, 3-(o-(2-benzimidazolyl)phenyl)-6-iodo-2-phenyl-
Basic information
- CAS
76618-05-8- Standard SMILES
O=c1c2cc(I)ccc2nc(-c2ccccc2)n1-c1ccccc1-c1nc2ccccc2[nH]1- InChIKey
RVOALXWXDRKAPQ-UHFFFAOYSA-N- Molecular formula
- C27H17IN4O
- Average molar mass
- 540.4 g/mol
- Monoisotopic mass
- 540.04471
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(o-(2-benzimidazolyl)phenyl)-6-iodo-2-phenyl-
- IUPAC
- 3-[2-(1H-benzimidazol-2-yl)phenyl]-6-iodo-2-phenylquinazolin-4-one
Names & synonyms
BRN 56526084(3H)-Quinazolinone, 3-(o-(2-benzimidazolyl)phenyl)-6-iodo-2-phenyl-76618-05-83-(o-(2-Benzimidazolyl)phenyl)-6-iodo-2-phenyl-4(3H)-quinazolinoneDTXSID60227438RefChem:284144DTXCID601499293-(2-(1H-benzo[d]imidazol-2-yl)phenyl)-6-iodo-2-phenylquinazolin-4(3H)-one3-[2-(1H-1,3-Benzimidazol-2-yl)phenyl]-6-iodo-2-phenylquinazolin-4(3H)-one
Database identifiers
- CAS
76618-05-8- PubChem CID
- 63584
- DTXSID
DTXSID60227438- Nikkaji
- J73.039D
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 752
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Compound notes
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