N-(2-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide
Formula:C14H11N4O2F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(2-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide is a drug-like molecule.
| MolName | N-(2-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide |
| MolecularFormula | C14H11N4O2F |
| Smiles | O=C(C(N/N=C\c1ccncc1)=O)Nc(cccc1)c1F |
| InChI | InChI=1S/C14H11FN4O2/c15-11-3-1-2-4-12(11)18-13(20)14(21)19-17-9-10-5-7-16-8-6-10/h1-9H,(H,18,20)(H,19,21) |
| InChIK | AQUMZKIOTNBMFU-UHFFFAOYSA-N |
| TotalMolweight | 286.265 |
| Molweight | 286.265 |
| MonoisotopicMass | 286.086604 |
| CLogP | 1.2438 |
| CLogS | -3.044 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 221.31 |
| Relative PSA | 0.32299 |
| PolarSurfaceArea | 83.45 |
| 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 | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 2 |
| Amides | 1 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - N-(2-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide | 2 - N-(2-fluorophenyl)-N'-[(Z)-pyridin-4-ylmethylideneamino]oxamide
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