4-bromo-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]benzamide
Formula:C19H14N3OBr
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
4-bromo-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]benzamide is a drug-like molecule.
| MolName | 4-bromo-N-[(E)-[phenyl(pyridin-2-yl)methylidene]amino]benzamide |
| MolecularFormula | C19H14N3OBr |
| Smiles | O=C(c(cc1)ccc1Br)N/N=C(\c1ccccc1)/c1ncccc1 |
| InChI | InChI=1S/C19H14BrN3O/c20-16-11-9-15(10-12-16)19(24)23-22-18(14-6-2-1-3-7-14)17-8-4-5-13-21-17/h1-13H,(H,23,24) |
| InChIK | WYZIFYIEVQXCPB-UHFFFAOYSA-N |
| TotalMolweight | 380.244 |
| Molweight | 380.244 |
| MonoisotopicMass | 379.032023 |
| CLogP | 4.1766 |
| CLogS | -5.56 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 262.35 |
| Relative PSA | 0.17907 |
| PolarSurfaceArea | 54.35 |
| Druglikeness | 1.5484 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.54167 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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