N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2,2-diphenoxyacetamide
Formula:C21H16N2O3Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2,2-diphenoxyacetamide is not a drug-like molecule.
| MolName | N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2,2-diphenoxyacetamide |
| MolecularFormula | C21H16N2O3Cl2 |
| Smiles | O=C(C(Oc1ccccc1)Oc1ccccc1)N/N=C\c1cccc(Cl)c1Cl |
| InChI | InChI=1S/C21H16Cl2N2O3/c22-18-13-7-8-15(19(18)23)14-24-25-20(26)21(27-16-9-3-1-4-10-16)28-17-11-5-2-6-12-17/h1-14,21H,(H,25,26) |
| InChIK | SCGOWBKBQWVLHT-UHFFFAOYSA-N |
| TotalMolweight | 415.275 |
| Molweight | 415.275 |
| MonoisotopicMass | 414.053797 |
| CLogP | 5.2262 |
| CLogS | -6.244 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 310.09 |
| Relative PSA | 0.18062 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | 4.5419 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.5 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 9 |
| StereoCon |
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1 - N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2,2-diphenoxyacetamide | 2 - N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2,2-diphenoxyacetamide
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