Basic information
- CAS
88514-19-6- Standard SMILES
Cc1ccc(-c2[nH]c3ccccc3c2Cn2cnc3ccc(Br)cc3c2=O)cc1- InChIKey
RJXUUGUGFQTKEZ-UHFFFAOYSA-N- Molecular formula
- C24H18BrN3O
- Average molar mass
- 444.3 g/mol
- Monoisotopic mass
- 443.06332
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 6-bromo-3-((2-(4-methylphenyl)-1H-indol-3-yl)methyl)-
- IUPAC
- 6-bromo-3-[[2-(4-methylphenyl)-1H-indol-3-yl]methyl]quinazolin-4-one
Names & synonyms
88514-19-64(3H)-Quinazolinone, 6-bromo-3-((2-(4-methylphenyl)-1H-indol-3-yl)methyl)-6-Bromo-3-((2-(4-methylphenyl)-1H-indol-3-yl)methyl)-4(3H)-quinazolinoneDTXSID30237089RefChem:284260DTXCID801595806-Bromo-3-{[2-(4-methylphenyl)-1H-indol-3-yl]methyl}quinazolin-4(3H)-one
Database identifiers
- CAS
88514-19-6- PubChem CID
- 63644
- DTXSID
DTXSID30237089
Properties
Computed structural properties
- XLogP
- 5.2
- Topological polar surface area
- 48.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 632
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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