| MolName | (Z)-N'-[2,2-bis(4-chlorophenyl)-2-hydroxyacetyl]-4-hydroxy-2-oxo-4-phenylbut-3-enehydrazide |
| MolecularFormula | C24H18N2O5Cl2 |
| Smiles | OC(C(NNC(C(/C=C(/c1ccccc1)\O)=O)=O)=O)(c(cc1)ccc1Cl)c(cc1)ccc1Cl |
| InChI | InChI=1S/C24H18Cl2N2O5/c25-18-10-6-16(7-11-18)24(33,17-8-12-19(26)13-9-17)23(32)28-27-22(31)21(30)14-20(29)15-4-2-1-3-5-15/h1-14,29,33H,(H,27,31)(H,28,32) |
| InChIK | OZPOUBRJKWOPTO-UHFFFAOYSA-N |
| TotalMolweight | 485.322 |
| Molweight | 485.322 |
| MonoisotopicMass | 484.059277 |
| CLogP | 2.1354 |
| CLogS | -5.313 |
| H Acceptors | 7 |
| H Donors | 4 |
| TotalSurfaceArea | 347.61 |
| Relative PSA | 0.25385 |
| PolarSurfaceArea | 115.73 |
| Druglikeness | 0.30401 |
| Mutagenic | low |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | |
| Shape Index | 0.51515 |
| Fragments | 1 |
| Non HAtoms | 33 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 11 |
| StereoCon |
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1 - (Z)-N'-[2,2-bis(4-chlorophenyl)-2-hydroxyacetyl]-4-hydroxy-2-oxo-4-phenylbut-3-enehydrazide | 2 - (Z)-N'-[2,2-bis(4-chlorophenyl)-2-hydroxyacetyl]-4-hydroxy-2-oxo-4-phenylbut-3-enehydrazide