| MolName | N,N'-bis[(Z)-pyridin-2-ylmethylideneamino]propanediamide |
| MolecularFormula | C15H14N6O2 |
| Smiles | O=C(CC(N/N=C\c1ncccc1)=O)N/N=C\c1ncccc1 |
| InChI | InChI=1S/C15H14N6O2/c22-14(20-18-10-12-5-1-3-7-16-12)9-15(23)21-19-11-13-6-2-4-8-17-13/h1-8,10-11H,9H2,(H,20,22)(H,21,23) |
| InChIK | XAQKFAPADNIIMD-UHFFFAOYSA-N |
| TotalMolweight | 310.316 |
| Molweight | 310.316 |
| MonoisotopicMass | 310.117824 |
| CLogP | 1.099 |
| CLogS | -2.846 |
| H Acceptors | 8 |
| H Donors | 2 |
| TotalSurfaceArea | 252.24 |
| Relative PSA | 0.3725 |
| PolarSurfaceArea | 108.7 |
| Druglikeness | 1.5105 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.73913 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 1 |
| Symmetricatoms | 11 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - N,N'-bis[(Z)-pyridin-2-ylmethylideneamino]propanediamide | 2 - N,N'-bis[(Z)-pyridin-2-ylmethylideneamino]propanediamide