| MolName | N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-methoxyphenoxy)acetamide |
| MolecularFormula | C18H18N2O5 |
| Smiles | C/C(/c(cc1)cc2c1OCO2)=N/NC(COc(cc1)ccc1OC)=O |
| InChI | InChI=1S/C18H18N2O5/c1-12(13-3-8-16-17(9-13)25-11-24-16)19-20-18(21)10-23-15-6-4-14(22-2)5-7-15/h3-9H,10-11H2,1-2H3,(H,20,21) |
| InChIK | HEADXBVKTCRXHA-UHFFFAOYSA-N |
| TotalMolweight | 342.35 |
| Molweight | 342.35 |
| MonoisotopicMass | 342.121573 |
| CLogP | 2.7558 |
| CLogS | -4.59 |
| H Acceptors | 7 |
| H Donors | 1 |
| TotalSurfaceArea | 263.74 |
| Relative PSA | 0.2882 |
| PolarSurfaceArea | 78.38 |
| Druglikeness | 3.1543 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.68 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 8 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-methoxyphenoxy)acetamide | 2 - N-[(Z)-1-(1,3-benzodioxol-5-yl)ethylideneamino]-2-(4-methoxyphenoxy)acetamide