2-hydroxy-N-[(Z)-[4-[(Z)-[(2-hydroxybenzoyl)hydrazinylidene]methyl]phenyl]methylideneamino]benzamide
Formula:C22H18N4O4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-hydroxy-N-[(Z)-[4-[(Z)-[(2-hydroxybenzoyl)hydrazinylidene]methyl]phenyl]methylideneamino]benzamide is a drug-like molecule.
| MolName | 2-hydroxy-N-[(Z)-[4-[(Z)-[(2-hydroxybenzoyl)hydrazinylidene]methyl]phenyl]methylideneamino]benzamide |
| MolecularFormula | C22H18N4O4 |
| Smiles | Oc(cccc1)c1C(N/N=C\c1ccc(/C=N\NC(c(cccc2)c2O)=O)cc1)=O |
| InChI | InChI=1S/C22H18N4O4/c27-19-7-3-1-5-17(19)21(29)25-23-13-15-9-11-16(12-10-15)14-24-26-22(30)18-6-2-4-8-20(18)28/h1-14,27-28H,(H,25,29)(H,26,30) |
| InChIK | UWXAKAVHGDTWTR-UHFFFAOYSA-N |
| TotalMolweight | 402.409 |
| Molweight | 402.409 |
| MonoisotopicMass | 402.132806 |
| CLogP | 4.0522 |
| CLogS | -5.234 |
| H Acceptors | 8 |
| H Donors | 4 |
| TotalSurfaceArea | 313.42 |
| Relative PSA | 0.31338 |
| PolarSurfaceArea | 123.38 |
| Druglikeness | 4.4204 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 30 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 16 |
| StereoCon |
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1 - 2-hydroxy-N-[(Z)-[4-[(Z)-[(2-hydroxybenzoyl)hydrazinylidene]methyl]phenyl]methylideneamino]benzamide | 2 - 2-hydroxy-N-[(Z)-[4-[(Z)-[(2-hydroxybenzoyl)hydrazinylidene]methyl]phenyl]methylideneamino]benzamide
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