| MolName | 2-[(3E)-3-(1,3-dioxoisoindol-2-yl)imino-2-oxoindol-1-yl]-N-phenylacetamide |
| MolecularFormula | C24H16N4O4 |
| Smiles | O=C(CN(c(cccc1)c1/C1=N\N(C(c2c3cccc2)=O)C3=O)C1=O)Nc1ccccc1 |
| InChI | InChI=1S/C24H16N4O4/c29-20(25-15-8-2-1-3-9-15)14-27-19-13-7-6-12-18(19)21(24(27)32)26-28-22(30)16-10-4-5-11-17(16)23(28)31/h1-13H,14H2,(H,25,29) |
| InChIK | JQYUMYVABJPPQC-UHFFFAOYSA-N |
| TotalMolweight | 424.415 |
| Molweight | 424.415 |
| MonoisotopicMass | 424.117156 |
| CLogP | 2.4276 |
| CLogS | -5.08 |
| H Acceptors | 8 |
| H Donors | 1 |
| TotalSurfaceArea | 305.57 |
| Relative PSA | 0.2691 |
| PolarSurfaceArea | 99.15 |
| Druglikeness | 6.5214 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 7 |
| Amides | 2 |
| StereoCon |
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1 - 2-[(3E)-3-(1,3-dioxoisoindol-2-yl)imino-2-oxoindol-1-yl]-N-phenylacetamide | 2 - 2-[(3E)-3-(1,3-dioxoisoindol-2-yl)imino-2-oxoindol-1-yl]-N-phenylacetamide