| MolName | (E)-3-(furan-2-yl)-N-[6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]hexyl]prop-2-enamide |
| MolecularFormula | C20H24N2O4 |
| Smiles | O=C(/C=C/c1ccco1)NCCCCCCNC(/C=C/c1ccco1)=O |
| InChI | InChI=1S/C20H24N2O4/c23-19(11-9-17-7-5-15-25-17)21-13-3-1-2-4-14-22-20(24)12-10-18-8-6-16-26-18/h5-12,15-16H,1-4,13-14H2,(H,21,23)(H,22,24) |
| InChIK | MSDFJZWVEKXLNI-UHFFFAOYSA-N |
| TotalMolweight | 356.421 |
| Molweight | 356.421 |
| MonoisotopicMass | 356.173608 |
| CLogP | 2.8856 |
| CLogS | -4.042 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 306.38 |
| Relative PSA | 0.25204 |
| PolarSurfaceArea | 84.48 |
| Druglikeness | -6.0265 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.76923 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 11 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Sp3Atoms | 6 |
| Symmetricatoms | 13 |
| Amides | 2 |
| StereoCon |
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1 - (E)-3-(furan-2-yl)-N-[6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]hexyl]prop-2-enamide | 2 - (E)-3-(furan-2-yl)-N-[6-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]hexyl]prop-2-enamide