| MolName | N,N'-bis[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanediamide |
| MolecularFormula | C28H34N4O2 |
| Smiles | O=C(CCCCCCC(N/N=C(/CCC1)\c2c1cccc2)=O)N/N=C(/CCC1)\c2c1cccc2 |
| InChI | InChI=1S/C28H34N4O2/c33-27(31-29-25-17-9-13-21-11-5-7-15-23(21)25)19-3-1-2-4-20-28(34)32-30-26-18-10-14-22-12-6-8-16-24(22)26/h5-8,11-12,15-16H,1-4,9-10,13-14,17-20H2,(H,31,33)(H,32,34) |
| InChIK | PBRWONXOPPXGDO-UHFFFAOYSA-N |
| TotalMolweight | 458.604 |
| Molweight | 458.604 |
| MonoisotopicMass | 458.268176 |
| CLogP | 6.6102 |
| CLogS | -7.636 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 375.5 |
| Relative PSA | 0.1918 |
| PolarSurfaceArea | 82.92 |
| Druglikeness | -4.9735 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.64706 |
| Fragments | 1 |
| Non HAtoms | 34 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 9 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 12 |
| Symmetricatoms | 17 |
| StereoCon |
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1 - N,N'-bis[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanediamide | 2 - N,N'-bis[(Z)-3,4-dihydro-2H-naphthalen-1-ylideneamino]octanediamide