| MolName | N-[(E)-(1-amino-2-phenoxyethylidene)amino]-2-phenoxypyridine-3-carboxamide |
| MolecularFormula | C20H18N4O3 |
| Smiles | N/C(/COc1ccccc1)=N/NC(c(cccn1)c1Oc1ccccc1)=O |
| InChI | InChI=1S/C20H18N4O3/c21-18(14-26-15-8-3-1-4-9-15)23-24-19(25)17-12-7-13-22-20(17)27-16-10-5-2-6-11-16/h1-13H,14H2,(H2,21,23)(H,24,25) |
| InChIK | DDUALJVVSUIDSW-UHFFFAOYSA-N |
| TotalMolweight | 362.388 |
| Molweight | 362.388 |
| MonoisotopicMass | 362.137891 |
| CLogP | 2.6766 |
| CLogS | -5.293 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 286 |
| Relative PSA | 0.28759 |
| PolarSurfaceArea | 98.83 |
| Druglikeness | 2.759 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.62963 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
Click to Load Molecule:
1 - N-[(E)-(1-amino-2-phenoxyethylidene)amino]-2-phenoxypyridine-3-carboxamide | 2 - N-[(E)-(1-amino-2-phenoxyethylidene)amino]-2-phenoxypyridine-3-carboxamide