| MolName | (E)-N,3-diphenyl-N-[2-(N-[(E)-3-phenylprop-2-enoyl]anilino)ethyl]prop-2-enamide |
| MolecularFormula | C32H28N2O2 |
| Smiles | O=C(/C=C/c1ccccc1)N(CCN(C(/C=C/c1ccccc1)=O)c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C32H28N2O2/c35-31(23-21-27-13-5-1-6-14-27)33(29-17-9-3-10-18-29)25-26-34(30-19-11-4-12-20-30)32(36)24-22-28-15-7-2-8-16-28/h1-24H,25-26H2 |
| InChIK | XGLRFLRVCHYAGE-UHFFFAOYSA-N |
| TotalMolweight | 472.586 |
| Molweight | 472.586 |
| MonoisotopicMass | 472.215078 |
| CLogP | 6.6068 |
| CLogS | -6.564 |
| H Acceptors | 4 |
| TotalSurfaceArea | 389.16 |
| Relative PSA | 0.085261 |
| PolarSurfaceArea | 40.62 |
| Druglikeness | 2.0971 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 36 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 9 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 2 |
| Symmetricatoms | 22 |
| Amides | 2 |
| StereoCon |
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1 - (E)-N,3-diphenyl-N-[2-(N-[(E)-3-phenylprop-2-enoyl]anilino)ethyl]prop-2-enamide | 2 - (E)-N,3-diphenyl-N-[2-(N-[(E)-3-phenylprop-2-enoyl]anilino)ethyl]prop-2-enamide