| MolName | (Z)-1-(3-phenylmethoxyphenyl)-N-[4-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]piperazin-1-yl]methanimine |
| MolecularFormula | C32H32N4O2 |
| Smiles | C(c1ccccc1)Oc1cccc(/C=N\N(CC2)CCN2/N=C\c2cccc(OCc3ccccc3)c2)c1 |
| InChI | InChI=1S/C32H32N4O2/c1-3-9-27(10-4-1)25-37-31-15-7-13-29(21-31)23-33-35-17-19-36(20-18-35)34-24-30-14-8-16-32(22-30)38-26-28-11-5-2-6-12-28/h1-16,21-24H,17-20,25-26H2 |
| InChIK | AQZKYYXLFNAIKT-UHFFFAOYSA-N |
| TotalMolweight | 504.632 |
| Molweight | 504.632 |
| MonoisotopicMass | 504.252526 |
| CLogP | 5.9552 |
| CLogS | -5.972 |
| H Acceptors | 6 |
| TotalSurfaceArea | 411.72 |
| Relative PSA | 0.12173 |
| PolarSurfaceArea | 49.66 |
| Druglikeness | 4.7274 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.68421 |
| Fragments | 1 |
| Non HAtoms | 38 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 10 |
| Rings Closures | 5 |
| Small Rings | 5 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Sp3Atoms | 10 |
| Symmetricatoms | 22 |
| StereoCon |
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1 - (Z)-1-(3-phenylmethoxyphenyl)-N-[4-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]piperazin-1-yl]methanimine | 2 - (Z)-1-(3-phenylmethoxyphenyl)-N-[4-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]piperazin-1-yl]methanimine