| MolName | N-[(Z)-3-[(2Z)-2-[(E)-3-(furan-2-yl)prop-2-enylidene]hydrazinyl]-3-oxo-1-phenylprop-1-en-2-yl]benzamide |
| MolecularFormula | C23H19N3O3 |
| Smiles | O=C(/C(/NC(c1ccccc1)=O)=C/c1ccccc1)N/N=C\C=C\c1ccco1 |
| InChI | InChI=1S/C23H19N3O3/c27-22(19-11-5-2-6-12-19)25-21(17-18-9-3-1-4-10-18)23(28)26-24-15-7-13-20-14-8-16-29-20/h1-17H,(H,25,27)(H,26,28) |
| InChIK | YJRXPJMPKSMMJK-UHFFFAOYSA-N |
| TotalMolweight | 385.422 |
| Molweight | 385.422 |
| MonoisotopicMass | 385.142642 |
| CLogP | 4.0253 |
| CLogS | -5.44 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 316.86 |
| Relative PSA | 0.2355 |
| PolarSurfaceArea | 83.7 |
| Druglikeness | 5.9951 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.55172 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - N-[(Z)-3-[(2Z)-2-[(E)-3-(furan-2-yl)prop-2-enylidene]hydrazinyl]-3-oxo-1-phenylprop-1-en-2-yl]benzamide | 2 - N-[(Z)-3-[(2Z)-2-[(E)-3-(furan-2-yl)prop-2-enylidene]hydrazinyl]-3-oxo-1-phenylprop-1-en-2-yl]benzamide