N-[(Z)-(4-phenoxyphenyl)methylideneamino]pyridine-4-carboxamide
Formula:C19H15N3O2
Mutagenic:none
Tumorigenic:high
Reproductive Effective:high
N-[(Z)-(4-phenoxyphenyl)methylideneamino]pyridine-4-carboxamide is a drug-like molecule.
| MolName | N-[(Z)-(4-phenoxyphenyl)methylideneamino]pyridine-4-carboxamide |
| MolecularFormula | C19H15N3O2 |
| Smiles | O=C(c1ccncc1)N/N=C\c(cc1)ccc1Oc1ccccc1 |
| InChI | InChI=1S/C19H15N3O2/c23-19(16-10-12-20-13-11-16)22-21-14-15-6-8-18(9-7-15)24-17-4-2-1-3-5-17/h1-14H,(H,22,23) |
| InChIK | CCEYAAAISXFPAP-UHFFFAOYSA-N |
| TotalMolweight | 317.347 |
| Molweight | 317.347 |
| MonoisotopicMass | 317.116427 |
| CLogP | 3.5963 |
| CLogS | -5.223 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 255.51 |
| Relative PSA | 0.223 |
| PolarSurfaceArea | 63.58 |
| Druglikeness | 4.3193 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.70833 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 6 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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