5-Benzyl-1,3-diazinane-2,4,6-trione
5-benzyl-1,3-diazinane-2,4,6-trione
Also Known As: 5-benzylbarbituric acid|5-benzyl-1,3-diazinane-2,4,6-trione|Phenobarbital Impurity 5|5-Benzyl-barbitursaeure|5-benzyl-barbituric acid|Phenylmethylbarbituric acid|Barbituric acid, 5-benzyl-|NCIOpen2_006051|Oprea1_455878|CBDivE_005571|MENIJRPFVLNJIH-UHFFFAOYSA-|5-benzylpyrimidine-2,4,6(1h,3h,5h)-trione|SDCCGMLS-0064601.P001|5-(Phenylmethyl)-2,4,6(1H,3H,5H)-pyrimidinetrione|5-benzyl-2,4,6-(1H,3H)-pyrimidinetrione|5-Benzyl-2,4,6(1H,3H,5H)-pyrimidinetrione|2,4,6(1H,3H,5H)-Pyrimidinetrione, 5-(phenylmethyl)-|5-Benzyl-2,4,6(1H,3H,5H)-pyrimidinetrione #|Pyrimidine-2,4,6(1H,3H,5H)-trione, 5-benzyl-|SR-01000397204-1
| Molecular Formula | C11H10N2O3 |
|---|---|
| Molecular Weight | 218.06914 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 75.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 218.06914 |
| Monoisotopic Mass | 218.06914 |
| Heavy Atoms | 16 |
| Complexity | 301.0 |
Chemical Identifiers
| CAS Number | 59554-45-9 |
|---|---|
| SMILES | C1=CC=C(C=C1)CC2C(=O)NC(=O)NC2=O |
| InChIKey | MENIJRPFVLNJIH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 7 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-Benzyl-1,3-diazinane-2,4,6-trione (CAS 59554-45-9), with molecular formula C11H10N2O3 and molecular weight 218.06914 g/mol. IUPAC: 5-benzyl-1,3-diazinane-2,4,6-trione.