N'-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-N-phenyloxamide
Formula:C22H18N3O3Cl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-N-phenyloxamide is a drug-like molecule.
| MolName | N'-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-N-phenyloxamide |
| MolecularFormula | C22H18N3O3Cl |
| Smiles | O=C(C(N/N=C\c(cc1)ccc1OCc(cc1)ccc1Cl)=O)Nc1ccccc1 |
| InChI | InChI=1S/C22H18ClN3O3/c23-18-10-6-17(7-11-18)15-29-20-12-8-16(9-13-20)14-24-26-22(28)21(27)25-19-4-2-1-3-5-19/h1-14H,15H2,(H,25,27)(H,26,28) |
| InChIK | KJDKGLTXDOAYCJ-UHFFFAOYSA-N |
| TotalMolweight | 407.856 |
| Molweight | 407.856 |
| MonoisotopicMass | 407.103669 |
| CLogP | 4.098 |
| CLogS | -5.602 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 315.14 |
| Relative PSA | 0.22374 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | 3.4149 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.72414 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| Amides | 1 |
| StereoCon |
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1 - N'-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-N-phenyloxamide | 2 - N'-[(Z)-[4-[(4-chlorophenyl)methoxy]phenyl]methylideneamino]-N-phenyloxamide
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