5-chloro-2-hydroxy-N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]benzamide
Formula:C19H14N3O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
5-chloro-2-hydroxy-N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]benzamide is a drug-like molecule.
| MolName | 5-chloro-2-hydroxy-N-[(E)-[phenyl(pyridin-4-yl)methylidene]amino]benzamide |
| MolecularFormula | C19H14N3O2Cl |
| Smiles | Oc(ccc(Cl)c1)c1C(N/N=C(\c1ccccc1)/c1ccncc1)=O |
| InChI | InChI=1S/C19H14ClN3O2/c20-15-6-7-17(24)16(12-15)19(25)23-22-18(13-4-2-1-3-5-13)14-8-10-21-11-9-14/h1-12,24H,(H,23,25) |
| InChIK | XARBWKJJMUHUNP-UHFFFAOYSA-N |
| TotalMolweight | 351.792 |
| Molweight | 351.792 |
| MonoisotopicMass | 351.077454 |
| CLogP | 3.6577 |
| CLogS | -5.142 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 265.49 |
| Relative PSA | 0.2263 |
| PolarSurfaceArea | 74.58 |
| Druglikeness | 3.3394 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.48 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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