| MolName | (E)-3-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(9H-fluoren-2-yl)prop-2-enamide |
| MolecularFormula | C26H17NO2Cl2 |
| Smiles | O=C(/C=C/c1ccc(-c(ccc(Cl)c2)c2Cl)o1)Nc(cc1)cc(C2)c1-c1c2cccc1 |
| InChI | InChI=1S/C26H17Cl2NO2/c27-18-5-9-23(24(28)15-18)25-11-7-20(31-25)8-12-26(30)29-19-6-10-22-17(14-19)13-16-3-1-2-4-21(16)22/h1-12,14-15H,13H2,(H,29,30) |
| InChIK | RFWIGIKKWAYMHW-UHFFFAOYSA-N |
| TotalMolweight | 446.332 |
| Molweight | 446.332 |
| MonoisotopicMass | 445.063633 |
| CLogP | 7.3055 |
| CLogS | -9.141 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 329.04 |
| Relative PSA | 0.11734 |
| PolarSurfaceArea | 42.24 |
| Druglikeness | 1.0454 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6129 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 23 |
| Sp3Atoms | 1 |
| Amides | 1 |
| StereoCon |
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1 - (E)-3-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(9H-fluoren-2-yl)prop-2-enamide | 2 - (E)-3-[5-(2,4-dichlorophenyl)furan-2-yl]-N-(9H-fluoren-2-yl)prop-2-enamide