N-[(Z)-[4-(N-phenylanilino)phenyl]methylideneamino]benzamide
Formula:C26H21N3O
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[4-(N-phenylanilino)phenyl]methylideneamino]benzamide is not a drug-like molecule.
| MolName | N-[(Z)-[4-(N-phenylanilino)phenyl]methylideneamino]benzamide |
| MolecularFormula | C26H21N3O |
| Smiles | O=C(c1ccccc1)N/N=C\c(cc1)ccc1N(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C26H21N3O/c30-26(22-10-4-1-5-11-22)28-27-20-21-16-18-25(19-17-21)29(23-12-6-2-7-13-23)24-14-8-3-9-15-24/h1-20H,(H,28,30) |
| InChIK | RBIAFDJVTHGIAN-UHFFFAOYSA-N |
| TotalMolweight | 391.473 |
| Molweight | 391.473 |
| MonoisotopicMass | 391.168462 |
| CLogP | 5.796 |
| CLogS | -7.897 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 316.81 |
| Relative PSA | 0.12487 |
| PolarSurfaceArea | 44.7 |
| Druglikeness | 5.0762 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.56667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 6 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 24 |
| Symmetricatoms | 12 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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