Basic information
- CAS
91045-34-0- Standard SMILES
O=c1c2ccccc2nc(-c2ccccc2)n1C(Cc1ccccc1)c1nc2ccccc2n1CN1CCCCC1- InChIKey
RSJYFZQFFGPSAN-UHFFFAOYSA-N- Molecular formula
- C35H33N5O
- Average molar mass
- 539.7 g/mol
- Monoisotopic mass
- 539.26851069
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 2-phenyl-3-(2-phenyl-1-(1-(1-piperidinylmethyl)-1H-benzimidazol-2-yl)ethyl)-
- IUPAC
- 2-phenyl-3-[2-phenyl-1-[1-(piperidin-1-ylmethyl)benzimidazol-2-yl]ethyl]quinazolin-4-one
Names & synonyms
91045-34-04(3H)-Quinazolinone, 2-phenyl-3-(2-phenyl-1-(1-(1-piperidinylmethyl)-1H-benzimidazol-2-yl)ethyl)-RefChem:283899DTXSID509199962-Phenyl-3-(2-phenyl-1-{1-[(piperidin-1-yl)methyl]-1H-1,3-benzimidazol-2-yl}ethyl)quinazolin-4(3H)-one2-Phenyl-3-(2-phenyl-1-{1-[(piperidin-1-yl)methyl]-1H-benzimidazol-2-yl}ethyl)quinazolin-4(3H)-one
Database identifiers
- CAS
91045-34-0- PubChem CID
- 64073
- DTXSID
DTXSID50919996
Properties
Computed structural properties
- XLogP
- 6.5
- Topological polar surface area
- 53.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 41
- Formal charge
- 0
- Complexity
- 904
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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