4(3H)-Quinazolinone, 3-(((3,4-dihydroxyphenyl)methyl)phenylamino)-2-phenyl-
Basic information
- CAS
71476-94-3- Standard SMILES
O=c1c2ccccc2nc(-c2ccccc2)n1N(Cc1ccc(O)c(O)c1)c1ccccc1- InChIKey
HWRZOCHOLXHNGM-UHFFFAOYSA-N- Molecular formula
- C27H21N3O3
- Average molar mass
- 435.5 g/mol
- Monoisotopic mass
- 435.15829154
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(((3,4-dihydroxyphenyl)methyl)phenylamino)-2-phenyl-
- IUPAC
- 3-[N-[(3,4-dihydroxyphenyl)methyl]anilino]-2-phenylquinazolin-4-one
Names & synonyms
BRN 08611204(3H)-Quinazolinone, 3-(((3,4-dihydroxyphenyl)methyl)phenylamino)-2-phenyl-71476-94-3DTXSID502216875-24-04-00223 (Beilstein Handbook Reference)3-(((3,4-Dihydroxyphenyl)methyl)phenylamino)-2-phenyl-4(3H)-quinazolinoneRefChem:283924DTXCID801441783-{[(3,4-Dihydroxyphenyl)methyl](phenyl)amino}-2-phenylquinazolin-4(3H)-one
Database identifiers
- CAS
71476-94-3- PubChem CID
- 63509
- DTXSID
DTXSID50221687
Properties
Computed structural properties
- XLogP
- 5.3
- Topological polar surface area
- 76.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 701
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Compound notes
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