| MolName | (E)-N-dibenzofuran-3-yl-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide |
| MolecularFormula | C25H15NO3Cl2 |
| Smiles | O=C(/C=C/c1ccc(-c(ccc(Cl)c2)c2Cl)o1)Nc(cc1)cc2c1c(cccc1)c1o2 |
| InChI | InChI=1S/C25H15Cl2NO3/c26-15-5-9-20(21(27)13-15)23-11-7-17(30-23)8-12-25(29)28-16-6-10-19-18-3-1-2-4-22(18)31-24(19)14-16/h1-14H,(H,28,29) |
| InChIK | AWTSQLUHXUIBKA-UHFFFAOYSA-N |
| TotalMolweight | 448.304 |
| Molweight | 448.304 |
| MonoisotopicMass | 447.042898 |
| CLogP | 7.0557 |
| CLogS | -9.09 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 327.91 |
| Relative PSA | 0.16078 |
| PolarSurfaceArea | 55.38 |
| Druglikeness | 1.102 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6129 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 5 |
| Aromatic Atoms | 24 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - (E)-N-dibenzofuran-3-yl-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide | 2 - (E)-N-dibenzofuran-3-yl-3-[5-(2,4-dichlorophenyl)furan-2-yl]prop-2-enamide