| MolName | 4-chloro-2-hydroxy-N'-[(3E)-4-phenylbuta-1,3-dien-2-yl]benzohydrazide |
| MolecularFormula | C17H15N2O2Cl |
| Smiles | C=C(/C=C/c1ccccc1)NNC(c(ccc(Cl)c1)c1O)=O |
| InChI | InChI=1S/C17H15ClN2O2/c1-12(7-8-13-5-3-2-4-6-13)19-20-17(22)15-10-9-14(18)11-16(15)21/h2-11,19,21H,1H2,(H,20,22) |
| InChIK | WZVQJJVXYQFHTG-UHFFFAOYSA-N |
| TotalMolweight | 314.771 |
| Molweight | 314.771 |
| MonoisotopicMass | 314.082205 |
| CLogP | 3.5856 |
| CLogS | -4.785 |
| H Acceptors | 4 |
| H Donors | 3 |
| TotalSurfaceArea | 244.71 |
| Relative PSA | 0.20048 |
| PolarSurfaceArea | 61.36 |
| Druglikeness | -0.71509 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.68182 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - 4-chloro-2-hydroxy-N'-[(3E)-4-phenylbuta-1,3-dien-2-yl]benzohydrazide | 2 - 4-chloro-2-hydroxy-N'-[(3E)-4-phenylbuta-1,3-dien-2-yl]benzohydrazide