| MolName | N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-3,5-dihydroxybenzamide |
| MolecularFormula | C14H12N2O4 |
| Smiles | Oc1cc(C(N/N=C\C=C\c2ccco2)=O)cc(O)c1 |
| InChI | InChI=1S/C14H12N2O4/c17-11-7-10(8-12(18)9-11)14(19)16-15-5-1-3-13-4-2-6-20-13/h1-9,17-18H,(H,16,19) |
| InChIK | MIYMKIBKZZXGIO-UHFFFAOYSA-N |
| TotalMolweight | 272.259 |
| Molweight | 272.259 |
| MonoisotopicMass | 272.079708 |
| CLogP | 1.7172 |
| CLogS | -3.103 |
| H Acceptors | 6 |
| H Donors | 3 |
| TotalSurfaceArea | 215.88 |
| Relative PSA | 0.35353 |
| PolarSurfaceArea | 95.06 |
| Druglikeness | 4.1783 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.65 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 2 |
| Symmetricatoms | 3 |
| StereoCon |
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1 - N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-3,5-dihydroxybenzamide | 2 - N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-3,5-dihydroxybenzamide