(2E)-2-[(Z)-(3,4-dichlorophenyl)methylidenehydrazinylidene]-1,2-diphenylethanone
Formula:C21H14N2OCl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2E)-2-[(Z)-(3,4-dichlorophenyl)methylidenehydrazinylidene]-1,2-diphenylethanone is not a drug-like molecule.
| MolName | (2E)-2-[(Z)-(3,4-dichlorophenyl)methylidenehydrazinylidene]-1,2-diphenylethanone |
| MolecularFormula | C21H14N2OCl2 |
| Smiles | O=C(/C(/c1ccccc1)=N/N=C\c(cc1)cc(Cl)c1Cl)c1ccccc1 |
| InChI | InChI=1S/C21H14Cl2N2O/c22-18-12-11-15(13-19(18)23)14-24-25-20(16-7-3-1-4-8-16)21(26)17-9-5-2-6-10-17/h1-14H |
| InChIK | CWZNGUQVTLLXDR-UHFFFAOYSA-N |
| TotalMolweight | 381.261 |
| Molweight | 381.261 |
| MonoisotopicMass | 380.048317 |
| CLogP | 6.4891 |
| CLogS | -7.28 |
| H Acceptors | 3 |
| TotalSurfaceArea | 289.1 |
| Relative PSA | 0.12473 |
| PolarSurfaceArea | 41.79 |
| Druglikeness | 2.8181 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | dimethylene-hydrazine; imine/hydrazone of aldehyde |
| Shape Index | 0.53846 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 4 |
| StereoCon |
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1 - (2E)-2-[(Z)-(3,4-dichlorophenyl)methylidenehydrazinylidene]-1,2-diphenylethanone | 2 - (2E)-2-[(Z)-(3,4-dichlorophenyl)methylidenehydrazinylidene]-1,2-diphenylethanone
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