| MolName | 2-anilino-N'-[(Z)-4-(4-chlorophenyl)-4-hydroxy-2-oxobut-3-enoyl]benzohydrazide |
| MolecularFormula | C23H18N3O4Cl |
| Smiles | O/C(/c(cc1)ccc1Cl)=C\C(C(NNC(c(cccc1)c1Nc1ccccc1)=O)=O)=O |
| InChI | InChI=1S/C23H18ClN3O4/c24-16-12-10-15(11-13-16)20(28)14-21(29)23(31)27-26-22(30)18-8-4-5-9-19(18)25-17-6-2-1-3-7-17/h1-14,25,28H,(H,26,30)(H,27,31) |
| InChIK | CLMYGKLMPOZLFX-UHFFFAOYSA-N |
| TotalMolweight | 435.866 |
| Molweight | 435.866 |
| MonoisotopicMass | 435.098584 |
| CLogP | 2.7795 |
| CLogS | -5.449 |
| H Acceptors | 7 |
| H Donors | 4 |
| TotalSurfaceArea | 326.89 |
| Relative PSA | 0.26492 |
| PolarSurfaceArea | 107.53 |
| Druglikeness | 0.070186 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6129 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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1 - 2-anilino-N'-[(Z)-4-(4-chlorophenyl)-4-hydroxy-2-oxobut-3-enoyl]benzohydrazide | 2 - 2-anilino-N'-[(Z)-4-(4-chlorophenyl)-4-hydroxy-2-oxobut-3-enoyl]benzohydrazide