N-[(E)-[(4-aminophenyl)-phenylmethylidene]amino]-N'-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]oxamide
Formula:C28H24N6O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(E)-[(4-aminophenyl)-phenylmethylidene]amino]-N'-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]oxamide is a drug-like molecule.
| MolName | N-[(E)-[(4-aminophenyl)-phenylmethylidene]amino]-N'-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]oxamide |
| MolecularFormula | C28H24N6O2 |
| Smiles | Nc(cc1)ccc1/C(/c1ccccc1)=N/NC(C(N/N=C(/c1ccccc1)\c(cc1)ccc1N)=O)=O |
| InChI | InChI=1S/C28H24N6O2/c29-23-15-11-21(12-16-23)25(19-7-3-1-4-8-19)31-33-27(35)28(36)34-32-26(20-9-5-2-6-10-20)22-13-17-24(30)18-14-22/h1-18H,29-30H2,(H,33,35)(H,34,36) |
| InChIK | GATBLJZDBMWHLG-UHFFFAOYSA-N |
| TotalMolweight | 476.539 |
| Molweight | 476.539 |
| MonoisotopicMass | 476.196074 |
| CLogP | 3.5772 |
| CLogS | -7.822 |
| H Acceptors | 8 |
| H Donors | 4 |
| TotalSurfaceArea | 373.94 |
| Relative PSA | 0.27427 |
| PolarSurfaceArea | 134.96 |
| Druglikeness | 2.2485 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; limit! oxal-diamide |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 36 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 7 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Symmetricatoms | 8 |
| Amines | 2 |
| Aromatic Amines | 2 |
| StereoCon |
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1 - N-[(E)-[(4-aminophenyl)-phenylmethylidene]amino]-N'-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]oxamide | 2 - N-[(E)-[(4-aminophenyl)-phenylmethylidene]amino]-N'-[(Z)-[(4-aminophenyl)-phenylmethylidene]amino]oxamide
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