N-(2-fluorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide
Formula:C15H11N3O2F2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(2-fluorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide is a drug-like molecule.
| MolName | N-(2-fluorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide |
| MolecularFormula | C15H11N3O2F2 |
| Smiles | O=C(C(N/N=C\c(cc1)ccc1F)=O)Nc(cccc1)c1F |
| InChI | InChI=1S/C15H11F2N3O2/c16-11-7-5-10(6-8-11)9-18-20-15(22)14(21)19-13-4-2-1-3-12(13)17/h1-9H,(H,19,21)(H,20,22) |
| InChIK | IFVJRSDPJZSSCK-UHFFFAOYSA-N |
| TotalMolweight | 303.267 |
| Molweight | 303.267 |
| MonoisotopicMass | 303.081933 |
| CLogP | 2.3455 |
| CLogS | -4.153 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 228.9 |
| Relative PSA | 0.26435 |
| PolarSurfaceArea | 70.56 |
| Druglikeness | 2.4078 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.68182 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| 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-(2-fluorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide | 2 - N-(2-fluorophenyl)-N'-[(Z)-(4-fluorophenyl)methylideneamino]oxamide
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