| MolName | 5-[(E)-2-phenylethenyl]-1,3-diazinane-2,4,6-trione |
| MolecularFormula | C12H10N2O3 |
| Smiles | O=C(C(/C=C/c1ccccc1)C(N1)=O)NC1=O |
| InChI | InChI=1S/C12H10N2O3/c15-10-9(11(16)14-12(17)13-10)7-6-8-4-2-1-3-5-8/h1-7,9H,(H2,13,14,15,16,17) |
| InChIK | RUHUUQNDUZBXKJ-UHFFFAOYSA-N |
| TotalMolweight | 230.222 |
| Molweight | 230.222 |
| MonoisotopicMass | 230.069143 |
| CLogP | 0.7024 |
| CLogS | -2.71 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 174.93 |
| Relative PSA | 0.35466 |
| PolarSurfaceArea | 75.27 |
| Druglikeness | 3.5633 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 17 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 2 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 1 |
| Symmetricatoms | 5 |
| Amides | 2 |
| StereoCon |
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1 - 5-[(E)-2-phenylethenyl]-1,3-diazinane-2,4,6-trione | 2 - 5-[(E)-2-phenylethenyl]-1,3-diazinane-2,4,6-trione