2-(4-chlorophenoxy)-N-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]acetamide
Formula:C20H16N3O2Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
2-(4-chlorophenoxy)-N-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]acetamide is a drug-like molecule.
| MolName | 2-(4-chlorophenoxy)-N-[(Z)-[phenyl(pyridin-2-yl)methylidene]amino]acetamide |
| MolecularFormula | C20H16N3O2Cl |
| Smiles | O=C(COc(cc1)ccc1Cl)N/N=C(/c1ccccc1)\c1ncccc1 |
| InChI | InChI=1S/C20H16ClN3O2/c21-16-9-11-17(12-10-16)26-14-19(25)23-24-20(15-6-2-1-3-7-15)18-8-4-5-13-22-18/h1-13H,14H2,(H,23,25) |
| InChIK | KMXJYWKKIUKUTO-UHFFFAOYSA-N |
| TotalMolweight | 365.819 |
| Molweight | 365.819 |
| MonoisotopicMass | 365.093104 |
| CLogP | 3.6323 |
| CLogS | -5.242 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 282.9 |
| Relative PSA | 0.20141 |
| PolarSurfaceArea | 63.58 |
| Druglikeness | 3.2023 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone |
| Shape Index | 0.57692 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 4 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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