N-[(Z)-[2-[(3,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-phenoxyacetamide
Formula:C22H18N2O3Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[2-[(3,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-phenoxyacetamide is not a drug-like molecule.
| MolName | N-[(Z)-[2-[(3,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-phenoxyacetamide |
| MolecularFormula | C22H18N2O3Cl2 |
| Smiles | O=C(COc1ccccc1)N/N=C\c(cccc1)c1OCc(cc1)cc(Cl)c1Cl |
| InChI | InChI=1S/C22H18Cl2N2O3/c23-19-11-10-16(12-20(19)24)14-29-21-9-5-4-6-17(21)13-25-26-22(27)15-28-18-7-2-1-3-8-18/h1-13H,14-15H2,(H,26,27) |
| InChIK | RDGRDAXJZZKWFV-UHFFFAOYSA-N |
| TotalMolweight | 429.302 |
| Molweight | 429.302 |
| MonoisotopicMass | 428.069447 |
| CLogP | 5.3366 |
| CLogS | -6.314 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 325.11 |
| Relative PSA | 0.17228 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | 4.2278 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.65517 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 8 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - N-[(Z)-[2-[(3,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-phenoxyacetamide | 2 - N-[(Z)-[2-[(3,4-dichlorophenyl)methoxy]phenyl]methylideneamino]-2-phenoxyacetamide
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