| MolName | N-[(Z)-3-[2-(hydrazinecarbonyl)anilino]-3-oxo-1-phenylprop-1-en-2-yl]benzamide |
| MolecularFormula | C23H20N4O3 |
| Smiles | NNC(c(cccc1)c1NC(/C(/NC(c1ccccc1)=O)=C/c1ccccc1)=O)=O |
| InChI | InChI=1S/C23H20N4O3/c24-27-22(29)18-13-7-8-14-19(18)25-23(30)20(15-16-9-3-1-4-10-16)26-21(28)17-11-5-2-6-12-17/h1-15H,24H2,(H,25,30)(H,26,28)(H,27,29) |
| InChIK | AHWQESFAFKESIR-UHFFFAOYSA-N |
| TotalMolweight | 400.437 |
| Molweight | 400.437 |
| MonoisotopicMass | 400.153541 |
| CLogP | 2.747 |
| CLogS | -5.239 |
| H Acceptors | 7 |
| H Donors | 4 |
| TotalSurfaceArea | 313.64 |
| Relative PSA | 0.28303 |
| PolarSurfaceArea | 113.32 |
| Druglikeness | -2.7473 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | hydrazine |
| Shape Index | 0.46667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Amides | 2 |
| StereoCon |
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1 - N-[(Z)-3-[2-(hydrazinecarbonyl)anilino]-3-oxo-1-phenylprop-1-en-2-yl]benzamide | 2 - N-[(Z)-3-[2-(hydrazinecarbonyl)anilino]-3-oxo-1-phenylprop-1-en-2-yl]benzamide