N-(2-chlorophenyl)-N'-[(Z)-(3-phenoxyphenyl)methylideneamino]oxamide
Formula:C21H16N3O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-(2-chlorophenyl)-N'-[(Z)-(3-phenoxyphenyl)methylideneamino]oxamide is a drug-like molecule.
| MolName | N-(2-chlorophenyl)-N'-[(Z)-(3-phenoxyphenyl)methylideneamino]oxamide |
| MolecularFormula | C21H16N3O3Cl |
| Smiles | O=C(C(N/N=C\c1cc(Oc2ccccc2)ccc1)=O)Nc(cccc1)c1Cl |
| InChI | InChI=1S/C21H16ClN3O3/c22-18-11-4-5-12-19(18)24-20(26)21(27)25-23-14-15-7-6-10-17(13-15)28-16-8-2-1-3-9-16/h1-14H,(H,24,26)(H,25,27) |
| InChIK | UNWIIOSNRKWALY-UHFFFAOYSA-N |
| TotalMolweight | 393.829 |
| Molweight | 393.829 |
| MonoisotopicMass | 393.088019 |
| CLogP | 4.1455 |
| CLogS | -6.558 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 301.38 |
| Relative PSA | 0.23396 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | 3.6564 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | low |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.64286 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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1 - N-(2-chlorophenyl)-N'-[(Z)-(3-phenoxyphenyl)methylideneamino]oxamide | 2 - N-(2-chlorophenyl)-N'-[(Z)-(3-phenoxyphenyl)methylideneamino]oxamide
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