| MolName | 5-chloro-N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-hydroxybenzamide |
| MolecularFormula | C14H11N2O3Cl |
| Smiles | Oc(ccc(Cl)c1)c1C(N/N=C\C=C\c1ccco1)=O |
| InChI | InChI=1S/C14H11ClN2O3/c15-10-5-6-13(18)12(9-10)14(19)17-16-7-1-3-11-4-2-8-20-11/h1-9,18H,(H,17,19) |
| InChIK | BEHHKLKWABJNHY-UHFFFAOYSA-N |
| TotalMolweight | 290.705 |
| Molweight | 290.705 |
| MonoisotopicMass | 290.04582 |
| CLogP | 2.6689 |
| CLogS | -4.135 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 224.95 |
| Relative PSA | 0.28104 |
| PolarSurfaceArea | 74.83 |
| Druglikeness | 4.2348 |
| 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 | 1 |
| StereoCon |
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1 - 5-chloro-N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-hydroxybenzamide | 2 - 5-chloro-N-[(Z)-[(E)-3-(furan-2-yl)prop-2-enylidene]amino]-2-hydroxybenzamide