| MolName | (E)-3-phenyl-N-[4-[[(E)-3-phenylprop-2-enoyl]amino]cyclohexyl]prop-2-enamide |
| MolecularFormula | C24H26N2O2 |
| Smiles | O=C(/C=C/c1ccccc1)NC(CC1)CCC1NC(/C=C/c1ccccc1)=O |
| InChI | InChI=1S/C24H26N2O2/c27-23(17-11-19-7-3-1-4-8-19)25-21-13-15-22(16-14-21)26-24(28)18-12-20-9-5-2-6-10-20/h1-12,17-18,21-22H,13-16H2,(H,25,27)(H,26,28) |
| InChIK | OVWBRASWAHTBTI-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 | -0.15005 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 17 |
| Amides | 2 |
| StereoCon |
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1 - (E)-3-phenyl-N-[4-[[(E)-3-phenylprop-2-enoyl]amino]cyclohexyl]prop-2-enamide | 2 - (E)-3-phenyl-N-[4-[[(E)-3-phenylprop-2-enoyl]amino]cyclohexyl]prop-2-enamide