Basic information
- CAS
80884-16-8- Standard SMILES
Cc1ccc(CCNCc2nc3ccccc3c(=O)n2-c2ccc(Cl)cc2)cc1- InChIKey
GTRCRVXBWICPSR-UHFFFAOYSA-N- Molecular formula
- C24H22ClN3O
- Average molar mass
- 403.9 g/mol
- Monoisotopic mass
- 403.14514
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(4-chlorophenyl)-2-(((2-(4-methylphenyl)ethyl)amino)methyl)-
- IUPAC
- 3-(4-chlorophenyl)-2-[[2-(4-methylphenyl)ethylamino]methyl]quinazolin-4-one
Names & synonyms
BRN 60066764(3H)-Quinazolinone, 3-(4-chlorophenyl)-2-(((2-(4-methylphenyl)ethyl)amino)methyl)-80884-16-8DTXSID102307703-(4-Chlorophenyl)-2-(((2-(4-methylphenyl)ethyl)amino)methyl)-4(3H)-quinazolinoneRefChem:284081DTXCID401532613-(4-Chlorophenyl)-2-({[2-(4-methylphenyl)ethyl]amino}methyl)quinazolin-4(3H)-one
Database identifiers
- CAS
80884-16-8- PubChem CID
- 63607
- DTXSID
DTXSID10230770
Properties
Computed structural properties
- XLogP
- 5
- Topological polar surface area
- 44.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 579
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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