4(3H)-Quinazolinone, 3-(1-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-methylpropyl)-2-phenyl-
Basic information
- CAS
65925-21-5- Standard SMILES
Cc1cc2nc(C(C(C)C)n3c(-c4ccccc4)nc4ccccc4c3=O)[nH]c2cc1C- InChIKey
JBNYBDMQUFBZLV-UHFFFAOYSA-N- Molecular formula
- C27H26N4O
- Average molar mass
- 422.5 g/mol
- Monoisotopic mass
- 422.21066147
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(1-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-methylpropyl)-2-phenyl-
- IUPAC
- 3-[1-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-methylpropyl]-2-phenylquinazolin-4-one
Names & synonyms
BRN 07183733-(1-(5,6-Dimethyl-1H-benzimidazol-2-yl)-2-methylpropyl)-2-phenyl-4(3H)-quinazolinone65925-21-55-25-11-00086 (Beilstein Handbook Reference)4(3H)-Quinazolinone, 3-(1-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-methylpropyl)-2-phenyl-RefChem:283949DTXSID809844103-[1-(5,6-Dimethyl-1H-benzimidazol-2-yl)-2-methylpropyl]-2-phenylquinazolin-4(3H)-one3-[1-(5,6-Dimethyl-1H-1,3-benzimidazol-2-yl)-2-methylpropyl]-2-phenylquinazolin-4(3H)-one
Database identifiers
- CAS
65925-21-5- PubChem CID
- 63806
- DTXSID
DTXSID80984410
Properties
Computed structural properties
- XLogP
- 5.7
- Topological polar surface area
- 61.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 714
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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