| MolName | N-[(E)-6-bicyclo[3.2.0]hept-3-enylideneamino]-2-(2-phenoxyethoxy)benzamide |
| MolecularFormula | C22H22N2O3 |
| Smiles | O=C(c(cccc1)c1OCCOc1ccccc1)N/N=C1/C2C=CCC2C1 |
| InChI | InChI=1S/C22H22N2O3/c25-22(24-23-20-15-16-7-6-11-18(16)20)19-10-4-5-12-21(19)27-14-13-26-17-8-2-1-3-9-17/h1-6,8-12,16,18H,7,13-15H2,(H,24,25) |
| InChIK | QYVASZVDRCWSPU-UHFFFAOYSA-N |
| TotalMolweight | 362.428 |
| Molweight | 362.428 |
| MonoisotopicMass | 362.163043 |
| CLogP | 3.9353 |
| CLogS | -4.759 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 284.74 |
| Relative PSA | 0.19671 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | -4.7907 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.62963 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| StereoCenters | 2 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 5 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 8 |
| Symmetricatoms | 2 |
| StereoCon | unknown chirality |
Click to Load Molecule:
1 - N-[(E)-6-bicyclo[3.2.0]hept-3-enylideneamino]-2-(2-phenoxyethoxy)benzamide | 2 - N-[(E)-6-bicyclo[3.2.0]hept-3-enylideneamino]-2-(2-phenoxyethoxy)benzamide