| MolName | 2-[4-[(Z)-(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]phenoxy]-N-(4-fluorophenyl)acetamide |
| MolecularFormula | C24H18N3O4F |
| Smiles | O=C(COc1ccc(/C=C(/C(N2c3ccccc3)=O)\NC2=O)cc1)Nc(cc1)ccc1F |
| InChI | InChI=1S/C24H18FN3O4/c25-17-8-10-18(11-9-17)26-22(29)15-32-20-12-6-16(7-13-20)14-21-23(30)28(24(31)27-21)19-4-2-1-3-5-19/h1-14H,15H2,(H,26,29)(H,27,31) |
| InChIK | CSARCPQTGHFFDY-UHFFFAOYSA-N |
| TotalMolweight | 431.422 |
| Molweight | 431.422 |
| MonoisotopicMass | 431.128135 |
| CLogP | 3.4396 |
| CLogS | -5.825 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 320.57 |
| Relative PSA | 0.2358 |
| PolarSurfaceArea | 87.74 |
| Druglikeness | 2.6154 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | limit! 5-methylene-imidazolidine-2,4-dione |
| Shape Index | 0.65625 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| Amides | 3 |
| StereoCon |
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1 - 2-[4-[(Z)-(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]phenoxy]-N-(4-fluorophenyl)acetamide | 2 - 2-[4-[(Z)-(2,5-dioxo-1-phenylimidazolidin-4-ylidene)methyl]phenoxy]-N-(4-fluorophenyl)acetamide