2-anilino-N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]acetamide
Formula:C22H21N3O2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-anilino-N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]acetamide is a drug-like molecule.
| MolName | 2-anilino-N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]acetamide |
| MolecularFormula | C22H21N3O2 |
| Smiles | O=C(CNc1ccccc1)N/N=C\c1cc(OCc2ccccc2)ccc1 |
| InChI | InChI=1S/C22H21N3O2/c26-22(16-23-20-11-5-2-6-12-20)25-24-15-19-10-7-13-21(14-19)27-17-18-8-3-1-4-9-18/h1-15,23H,16-17H2,(H,25,26) |
| InChIK | RDDNOZIAMXVWJW-UHFFFAOYSA-N |
| TotalMolweight | 359.428 |
| Molweight | 359.428 |
| MonoisotopicMass | 359.163377 |
| CLogP | 3.8416 |
| CLogS | -4.884 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 295.73 |
| Relative PSA | 0.19433 |
| PolarSurfaceArea | 62.72 |
| Druglikeness | 4.666 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.7037 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 8 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Amines | 1 |
| Aromatic Amines | 1 |
| StereoCon |
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1 - 2-anilino-N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]acetamide | 2 - 2-anilino-N-[(Z)-(3-phenylmethoxyphenyl)methylideneamino]acetamide
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