Basic information
- CAS
28513-42-0- Standard SMILES
CCCc1nc2ccccc2c(=O)n1-c1cc(C)c(O)c(C)c1- InChIKey
YXIWNSLZQISSPB-UHFFFAOYSA-N- Molecular formula
- C19H20N2O2
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.15247789
Names & identifiers
- Preferred name
- 4(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl-
- IUPAC
- 3-(4-hydroxy-3,5-dimethylphenyl)-2-propylquinazolin-4-one
Names & synonyms
28513-42-0BRN 0687534SRC-6904(3H)-Quinazolinone, 3-(3,5-dimethyl-4-hydroxyphenyl)-2-propyl-3-(4-Hydroxy-3,5-xylyl)-2-propyl-4(3H)-quinazolinone4(3H)-Quinazolinone, 3-(4-hydroxy-3,5-xylyl)-2-propyl-DTXSID201827365-24-03-00322 (Beilstein Handbook Reference)RefChem:284024DTXCID601052274(3H)-Quinazolinone, 3-(4-hydroxy-3,5-xylyl)-2-propyl-(8CI)3-(4-Hydroxy-3,5-dimethylphenyl)-2-propylquinazolin-4(3H)-one
Show more names
3-(4-hydroxy-3,5-dimethylphenyl)-2-propyl-3,4-dihydroquinazolin-4-one
Database identifiers
- CAS
28513-42-0- PubChem CID
- 64086
- DTXSID
DTXSID20182736
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 52.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 464
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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