N-[(Z)-[4-[(Z)-(benzoylhydrazinylidene)methyl]phenyl]methylideneamino]benzamide
Formula:C22H18N4O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[4-[(Z)-(benzoylhydrazinylidene)methyl]phenyl]methylideneamino]benzamide is a drug-like molecule.
| MolName | N-[(Z)-[4-[(Z)-(benzoylhydrazinylidene)methyl]phenyl]methylideneamino]benzamide |
| MolecularFormula | C22H18N4O2 |
| Smiles | O=C(c1ccccc1)N/N=C\c1ccc(/C=N\NC(c2ccccc2)=O)cc1 |
| InChI | InChI=1S/C22H18N4O2/c27-21(19-7-3-1-4-8-19)25-23-15-17-11-13-18(14-12-17)16-24-26-22(28)20-9-5-2-6-10-20/h1-16H,(H,25,27)(H,26,28) |
| InChIK | JCQGLXIDBBFVRO-UHFFFAOYSA-N |
| TotalMolweight | 370.411 |
| Molweight | 370.411 |
| MonoisotopicMass | 370.142976 |
| CLogP | 4.7436 |
| CLogS | -5.826 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 300.72 |
| Relative PSA | 0.23949 |
| PolarSurfaceArea | 82.92 |
| Druglikeness | 4.4687 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.71429 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 17 |
| StereoCon |
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1 - N-[(Z)-[4-[(Z)-(benzoylhydrazinylidene)methyl]phenyl]methylideneamino]benzamide | 2 - N-[(Z)-[4-[(Z)-(benzoylhydrazinylidene)methyl]phenyl]methylideneamino]benzamide
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