(2Z)-2-(cycloheptylidenehydrazinylidene)-1,2-diphenylethanone
Formula:C21H22N2O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2Z)-2-(cycloheptylidenehydrazinylidene)-1,2-diphenylethanone is not a drug-like molecule.
| MolName | (2Z)-2-(cycloheptylidenehydrazinylidene)-1,2-diphenylethanone |
| MolecularFormula | C21H22N2O |
| Smiles | O=C(/C(/c1ccccc1)=N\N=C1CCCCCC1)c1ccccc1 |
| InChI | InChI=1S/C21H22N2O/c24-21(18-13-7-4-8-14-18)20(17-11-5-3-6-12-17)23-22-19-15-9-1-2-10-16-19/h3-8,11-14H,1-2,9-10,15-16H2 |
| InChIK | KFTNEDMJZSJNNL-UHFFFAOYSA-N |
| TotalMolweight | 318.419 |
| Molweight | 318.419 |
| MonoisotopicMass | 318.173213 |
| CLogP | 5.3698 |
| CLogS | -5.94 |
| H Acceptors | 3 |
| TotalSurfaceArea | 265.77 |
| Relative PSA | 0.13568 |
| PolarSurfaceArea | 41.79 |
| Druglikeness | -3.2692 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | dimethylene-hydrazine |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 6 |
| Symmetricatoms | 7 |
| StereoCon |
Click to Load Molecule:
1 - (2Z)-2-(cycloheptylidenehydrazinylidene)-1,2-diphenylethanone | 2 - (2Z)-2-(cycloheptylidenehydrazinylidene)-1,2-diphenylethanone
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off