Basic information
- CAS
34486-71-0- Standard SMILES
C=CCC1(CC=C)C(=O)NC(=O)N(CCc2ccccc2)C1=O- InChIKey
DLKVITCFMFWCSL-UHFFFAOYSA-N- Molecular formula
- C18H20N2O3
- Average molar mass
- 312.4 g/mol
- Monoisotopic mass
- 312.1473925
Names & identifiers
- Preferred name
- Barbituric acid, 5,5-diallyl-1-phenethyl-
- IUPAC
- 1-(2-phenylethyl)-5,5-bis(prop-2-enyl)-1,3-diazinane-2,4,6-trione
- English name
- 1-(2-Phenylethyl)-5,5-di(2-propenyl)barbituric acid
- Molecular formula
- C18H20N2O3
- Molecular weight
- 0
Names & synonyms
BARBITURIC ACID, 5,5-DIALLYL-1-PHENETHYL-34486-71-0BRN 02961425,5-Diallyl-1-phenethylbarbituric acid2,4,6(1H,3H,5H)-Pyrimidinetrione, 1-(2-phenylethyl)-5,5-di-2-propenyl-1-(2-Phenylethyl)-5,5-di(2-propenyl)barbituric acidDTXSID301880421-(2-Phenylethyl)-5,5-di(prop-2-en-1-yl)-1,3-diazinane-2,4,6-trione5,5-diallyl-1-phenethyl-pyrimidine-2,4,6-trione
Database identifiers
- CAS
34486-71-0- PubChem CID
- 36836
- DTXSID
DTXSID30188042- Nikkaji
- J54.553H
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 66.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 496
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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