Basic information
- CAS
88514-49-2- Standard SMILES
Cc1ccc(-c2[nH]c3ccccc3c2Cn2c(C)nc3ccccc3c2=O)cc1- InChIKey
IQUDWKOVFMZAAO-UHFFFAOYSA-N- Molecular formula
- C25H21N3O
- Average molar mass
- 379.5 g/mol
- Monoisotopic mass
- 379.1684623
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 2-methyl-3-((2-(4-methylphenyl)-1H-indol-3-yl)methyl)-
- IUPAC
- 2-methyl-3-[[2-(4-methylphenyl)-1H-indol-3-yl]methyl]quinazolin-4-one
Names & synonyms
88514-49-24(3H)-Quinazolinone, 2-methyl-3-((2-(4-methylphenyl)-1H-indol-3-yl)methyl)-2-Methyl-3-((2-(4-methylphenyl)-1H-indol-3-yl)methyl)-4(3H)-quinazolinoneDTXSID50237102RefChem:283868DTXCID101595932-methyl-3-{[2-(4-methylphenyl)-1H-indol-3-yl]methyl}quinazolin-4(3H)-one
Database identifiers
- CAS
88514-49-2- PubChem CID
- 63647
- DTXSID
DTXSID50237102
Properties
Computed structural properties
- XLogP
- 4.5
- 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
- 638
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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