Basic information
- CAS
34486-70-9- Standard SMILES
C=CCC1(CC=C)C(=O)NC(=O)N(C(C)Cc2ccccc2)C1=O- InChIKey
OQJUZBZLWWZNTJ-UHFFFAOYSA-N- Molecular formula
- C19H22N2O3
- Average molar mass
- 326.4 g/mol
- Monoisotopic mass
- 326.16304257
Names & identifiers
- Preferred name
- 6-Hydroxy-3-(1-phenylpropan-2-yl)-5,5-di(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dione
- IUPAC
- 1-(1-phenylpropan-2-yl)-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
Names & synonyms
34486-70-9DTXSID409560176-Hydroxy-3-(1-phenylpropan-2-yl)-5,5-di(prop-2-en-1-yl)pyrimidine-2,4(3H,5H)-dioneRefChem:1073975DTXCID701383995BRN 06882155,5-Diallyl-1-(alpha-methylphenethyl)barbituric acidBarbituric acid, 5,5-diallyl-1-(alpha-methylphenethyl)-2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-(1-methyl-2-phenylethyl)-5,5-di-2-propenyl-5-24-09-00249 (Beilstein Handbook Reference)
Database identifiers
- CAS
34486-70-9- PubChem CID
- 214857
- DTXSID
DTXSID40956017
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 525
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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