| MolName | (E)-3-(furan-2-yl)-N-[7-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]heptyl]prop-2-enamide |
| MolecularFormula | C21H26N2O4 |
| Smiles | O=C(/C=C/c1ccco1)NCCCCCCCNC(/C=C/c1ccco1)=O |
| InChI | InChI=1S/C21H26N2O4/c24-20(12-10-18-8-6-16-26-18)22-14-4-2-1-3-5-15-23-21(25)13-11-19-9-7-17-27-19/h6-13,16-17H,1-5,14-15H2,(H,22,24)(H,23,25) |
| InChIK | YUKYTDWYGHOFQQ-UHFFFAOYSA-N |
| TotalMolweight | 370.447 |
| Molweight | 370.447 |
| MonoisotopicMass | 370.189258 |
| CLogP | 3.34 |
| CLogS | -4.312 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 320.14 |
| Relative PSA | 0.24121 |
| PolarSurfaceArea | 84.48 |
| Druglikeness | -6.0265 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.77778 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 12 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 10 |
| Sp3Atoms | 7 |
| Symmetricatoms | 13 |
| Amides | 2 |
| StereoCon |
Click to Load Molecule:
1 - (E)-3-(furan-2-yl)-N-[7-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]heptyl]prop-2-enamide | 2 - (E)-3-(furan-2-yl)-N-[7-[[(E)-3-(furan-2-yl)prop-2-enoyl]amino]heptyl]prop-2-enamide