| MolName | 3-fluoro-N-[2-[(2Z)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide |
| MolecularFormula | C16H14N3O3F |
| Smiles | Oc1cccc(/C=N\NC(CNC(c2cccc(F)c2)=O)=O)c1 |
| InChI | InChI=1S/C16H14FN3O3/c17-13-5-2-4-12(8-13)16(23)18-10-15(22)20-19-9-11-3-1-6-14(21)7-11/h1-9,21H,10H2,(H,18,23)(H,20,22) |
| InChIK | RCOAIMWPUNSTAQ-UHFFFAOYSA-N |
| TotalMolweight | 315.303 |
| Molweight | 315.303 |
| MonoisotopicMass | 315.10192 |
| CLogP | 2.0404 |
| CLogS | -3.506 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 242.66 |
| Relative PSA | 0.30335 |
| PolarSurfaceArea | 90.79 |
| Druglikeness | 3.9706 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.65217 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - 3-fluoro-N-[2-[(2Z)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide | 2 - 3-fluoro-N-[2-[(2Z)-2-[(3-hydroxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]benzamide