| MolName | N'-[(E)-3-(3-chlorophenyl)prop-2-enoyl]benzohydrazide |
| MolecularFormula | C16H13N2O2Cl |
| Smiles | O=C(/C=C/c1cccc(Cl)c1)NNC(c1ccccc1)=O |
| InChI | InChI=1S/C16H13ClN2O2/c17-14-8-4-5-12(11-14)9-10-15(20)18-19-16(21)13-6-2-1-3-7-13/h1-11H,(H,18,20)(H,19,21) |
| InChIK | WXYPWZXFQFPWSV-UHFFFAOYSA-N |
| TotalMolweight | 300.744 |
| Molweight | 300.744 |
| MonoisotopicMass | 300.066555 |
| CLogP | 2.5528 |
| CLogS | -4.416 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 233.36 |
| Relative PSA | 0.20998 |
| PolarSurfaceArea | 58.2 |
| Druglikeness | 0.66566 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - N'-[(E)-3-(3-chlorophenyl)prop-2-enoyl]benzohydrazide | 2 - N'-[(E)-3-(3-chlorophenyl)prop-2-enoyl]benzohydrazide