Basic information
- CAS
50840-25-0- Standard SMILES
Cc1nc2ccccc2c(=O)n1CCc1ccccc1- InChIKey
OAIJPTGFGSKJKY-UHFFFAOYSA-N- Molecular formula
- C17H16N2O
- Average molar mass
- 264.32 g/mol
- Monoisotopic mass
- 264.12626314
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 2-methyl-3-phenethyl-
- IUPAC
- 2-methyl-3-(2-phenylethyl)quinazolin-4-one
Names & synonyms
4(3H)-Quinazolinone, 2-methyl-3-phenethyl-2-Methyl-3-phenethyl-4(3H)-quinazolinone50840-25-0DTXSID80198878RefChem:283894DTXCID401213692-methyl-3-phenethylquinazolin-4(3H)-one2-methyl-3-(2-phenylethyl)quinazolin-4(3H)-oneMLS001164986SCHEMBL5748764CHEMBL1360094OAIJPTGFGSKJKY-UHFFFAOYSA-N
Show more names
HMS2868F23STL511089AKOS030495786NCGC00246221-01SMR0005402502-Methyl-3-phenethyl-3H-quinazolin-4-one
Database identifiers
- CAS
50840-25-0- PubChem CID
- 63248
- DTXSID
DTXSID80198878- ChEMBL
CHEMBL1360094- Nikkaji
- J2.042.255F
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 384
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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