N-(3,4-dichlorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide
Formula:C15H10N3O2Cl2F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(3,4-dichlorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide is a drug-like molecule.
| MolName | N-(3,4-dichlorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide |
| MolecularFormula | C15H10N3O2Cl2F |
| Smiles | O=C(C(N/N=C\c(cc1)ccc1F)=O)Nc(cc1)cc(Cl)c1Cl |
| InChI | InChI=1S/C15H10Cl2FN3O2/c16-12-6-5-11(7-13(12)17)20-14(22)15(23)21-19-8-9-1-3-10(18)4-2-9/h1-8H,(H,20,22)(H,21,23) |
| InChIK | PHGAJLQLMYRFAK-UHFFFAOYSA-N |
| TotalMolweight | 354.167 |
| Molweight | 354.167 |
| MonoisotopicMass | 353.013409 |
| CLogP | 3.4567 |
| CLogS | -5.311 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 253.39 |
| Relative PSA | 0.2388 |
| PolarSurfaceArea | 70.56 |
| Druglikeness | 2.42 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.69565 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - N-(3,4-dichlorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide | 2 - N-(3,4-dichlorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide
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