Basic information
- CAS
71476-98-7- Standard SMILES
Cc1nc2ccccc2c(=O)n1N(Cc1ccc(O)cc1O)c1ccccc1- InChIKey
HKLWQIKZUPBRLZ-UHFFFAOYSA-N- Molecular formula
- C22H19N3O3
- Average molar mass
- 373.4 g/mol
- Monoisotopic mass
- 373.14264148
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(((2,4-dihydroxyphenyl)methyl)phenylamino)-2-methyl-
- IUPAC
- 3-[N-[(2,4-dihydroxyphenyl)methyl]anilino]-2-methylquinazolin-4-one
Names & synonyms
71476-98-74(3H)-Quinazolinone, 3-(((2,4-dihydroxyphenyl)methyl)phenylamino)-2-methyl-3-(((2,4-Dihydroxyphenyl)methyl)phenylamino)-2-methyl-4(3H)-quinazolinoneDTXSID80221690RefChem:283920DTXCID101441813-{[(2,4-Dihydroxyphenyl)methyl](phenyl)amino}-2-methylquinazolin-4(3H)-one
Database identifiers
- CAS
71476-98-7- PubChem CID
- 63267
- DTXSID
DTXSID80221690
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 76.4 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 590
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…