N-[(Z)-benzylideneamino]-6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxamide
Formula:C24H18N4O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-benzylideneamino]-6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-benzylideneamino]-6-oxo-3,4-diphenyl-1H-pyridazine-5-carboxamide |
| MolecularFormula | C24H18N4O2 |
| Smiles | O=C(C1=C(c2ccccc2)C(c2ccccc2)=NNC1=O)N/N=C\c1ccccc1 |
| InChI | InChI=1S/C24H18N4O2/c29-23(27-25-16-17-10-4-1-5-11-17)21-20(18-12-6-2-7-13-18)22(26-28-24(21)30)19-14-8-3-9-15-19/h1-16H,(H,27,29)(H,28,30) |
| InChIK | IXHFZESHVWBWGU-UHFFFAOYSA-N |
| TotalMolweight | 394.433 |
| Molweight | 394.433 |
| MonoisotopicMass | 394.142976 |
| CLogP | 3.6142 |
| CLogS | -5.417 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 308.35 |
| Relative PSA | 0.23357 |
| PolarSurfaceArea | 82.92 |
| Druglikeness | 5.6629 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | twice activated DB; acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 6 |
| StereoCon |
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