N-phenyl-N'-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]oxamide
Formula:C17H15N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-phenyl-N'-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]oxamide is a drug-like molecule.
| MolName | N-phenyl-N'-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]oxamide |
| MolecularFormula | C17H15N3O2 |
| Smiles | O=C(C(N/N=C\C=C\c1ccccc1)=O)Nc1ccccc1 |
| InChI | InChI=1S/C17H15N3O2/c21-16(19-15-11-5-2-6-12-15)17(22)20-18-13-7-10-14-8-3-1-4-9-14/h1-13H,(H,19,21)(H,20,22) |
| InChIK | DWIJSLFNALYLAZ-UHFFFAOYSA-N |
| TotalMolweight | 293.325 |
| Molweight | 293.325 |
| MonoisotopicMass | 293.116427 |
| CLogP | 2.1622 |
| CLogS | -3.817 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 242.7 |
| Relative PSA | 0.24932 |
| PolarSurfaceArea | 70.56 |
| Druglikeness | 3.7552 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.72727 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - N-phenyl-N'-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]oxamide | 2 - N-phenyl-N'-[(Z)-[(E)-3-phenylprop-2-enylidene]amino]oxamide
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