| MolName | (E)-3-phenyl-N-[2-[[(E)-3-phenylprop-2-enoyl]amino]cyclohexyl]prop-2-enamide |
| MolecularFormula | C24H26N2O2 |
| Smiles | O=C(/C=C/c1ccccc1)NC(CCCC1)C1NC(/C=C/c1ccccc1)=O |
| InChI | InChI=1S/C24H26N2O2/c27-23(17-15-19-9-3-1-4-10-19)25-21-13-7-8-14-22(21)26-24(28)18-16-20-11-5-2-6-12-20/h1-6,9-12,15-18,21-22H,7-8,13-14H2,(H,25,27)(H,26,28) |
| InChIK | LQZUNAPYHWPRBG-UHFFFAOYSA-N |
| TotalMolweight | 374.482 |
| Molweight | 374.482 |
| MonoisotopicMass | 374.199428 |
| CLogP | 3.9146 |
| CLogS | -4.98 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 310.98 |
| Relative PSA | 0.15757 |
| PolarSurfaceArea | 58.2 |
| Druglikeness | -4.0915 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| StereoCenters | 2 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 16 |
| Amides | 2 |
| StereoCon | unknown chirality |
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1 - (E)-3-phenyl-N-[2-[[(E)-3-phenylprop-2-enoyl]amino]cyclohexyl]prop-2-enamide | 2 - (E)-3-phenyl-N-[2-[[(E)-3-phenylprop-2-enoyl]amino]cyclohexyl]prop-2-enamide