| MolName | 2-(4-fluorophenoxy)-N'-[1-(3-nitrophenyl)ethenyl]acetohydrazide |
| MolecularFormula | C16H14N3O4F |
| Smiles | C=C(c1cc([N+]([O-])=O)ccc1)NNC(COc(cc1)ccc1F)=O |
| InChI | InChI=1S/C16H14FN3O4/c1-11(12-3-2-4-14(9-12)20(22)23)18-19-16(21)10-24-15-7-5-13(17)6-8-15/h2-9,18H,1,10H2,(H,19,21) |
| InChIK | FEYOUAZNZDPOBS-UHFFFAOYSA-N |
| TotalMolweight | 331.302 |
| Molweight | 331.302 |
| MonoisotopicMass | 331.096835 |
| CLogP | 0.8844 |
| CLogS | -4.189 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 250.22 |
| Relative PSA | 0.30525 |
| PolarSurfaceArea | 96.18 |
| Druglikeness | -7.466 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | aromatic nitro |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 7 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| AcidicOxygens | 1 |
| StereoCon |
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1 - 2-(4-fluorophenoxy)-N'-[1-(3-nitrophenyl)ethenyl]acetohydrazide | 2 - 2-(4-fluorophenoxy)-N'-[1-(3-nitrophenyl)ethenyl]acetohydrazide