| MolName | N,N'-bis[(Z)-pyridin-2-ylmethylideneamino]pentanediamide |
| MolecularFormula | C17H18N6O2 |
| Smiles | O=C(CCCC(N/N=C\c1ncccc1)=O)N/N=C\c1ncccc1 |
| InChI | InChI=1S/C17H18N6O2/c24-16(22-20-12-14-6-1-3-10-18-14)8-5-9-17(25)23-21-13-15-7-2-4-11-19-15/h1-4,6-7,10-13H,5,8-9H2,(H,22,24)(H,23,25) |
| InChIK | FLWQNBAFWTXYIC-UHFFFAOYSA-N |
| TotalMolweight | 338.37 |
| Molweight | 338.37 |
| MonoisotopicMass | 338.149124 |
| CLogP | 2.0078 |
| CLogS | -3.386 |
| H Acceptors | 8 |
| H Donors | 2 |
| TotalSurfaceArea | 279.76 |
| Relative PSA | 0.33586 |
| PolarSurfaceArea | 108.7 |
| Druglikeness | -1.2495 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.76 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 8 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 12 |
| Aromatic Nitrogens | 2 |
| StereoCon |
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1 - N,N'-bis[(Z)-pyridin-2-ylmethylideneamino]pentanediamide | 2 - N,N'-bis[(Z)-pyridin-2-ylmethylideneamino]pentanediamide