| MolName | N,N'-bis[(E)-[phenyl(pyridin-3-yl)methylidene]amino]oxamide |
| MolecularFormula | C26H20N6O2 |
| Smiles | O=C(C(N/N=C(\c1ccccc1)/c1cnccc1)=O)N/N=C(\c1ccccc1)/c1cnccc1 |
| InChI | InChI=1S/C26H20N6O2/c33-25(31-29-23(19-9-3-1-4-10-19)21-13-7-15-27-17-21)26(34)32-30-24(20-11-5-2-6-12-20)22-14-8-16-28-18-22/h1-18H,(H,31,33)(H,32,34) |
| InChIK | OJWCUVHVWYBSSX-UHFFFAOYSA-N |
| TotalMolweight | 448.485 |
| Molweight | 448.485 |
| MonoisotopicMass | 448.164774 |
| CLogP | 2.93 |
| CLogS | -6.08 |
| H Acceptors | 8 |
| H Donors | 2 |
| TotalSurfaceArea | 354.42 |
| Relative PSA | 0.26511 |
| PolarSurfaceArea | 108.7 |
| Druglikeness | 2.3015 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; limit! oxal-diamide |
| Shape Index | 0.47059 |
| Fragments | 1 |
| Non HAtoms | 34 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Symmetricatoms | 19 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - N,N'-bis[(E)-[phenyl(pyridin-3-yl)methylidene]amino]oxamide | 2 - N,N'-bis[(E)-[phenyl(pyridin-3-yl)methylidene]amino]oxamide