N-benzhydryl-2-[(Z)-(3,4-dichlorophenyl)methylideneamino]oxyacetamide
Formula:C22H18N2O2Cl2
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-benzhydryl-2-[(Z)-(3,4-dichlorophenyl)methylideneamino]oxyacetamide is not a drug-like molecule.
| MolName | N-benzhydryl-2-[(Z)-(3,4-dichlorophenyl)methylideneamino]oxyacetamide |
| MolecularFormula | C22H18N2O2Cl2 |
| Smiles | O=C(CO/N=C\c(cc1)cc(Cl)c1Cl)NC(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C22H18Cl2N2O2/c23-19-12-11-16(13-20(19)24)14-25-28-15-21(27)26-22(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-14,22H,15H2,(H,26,27) |
| InChIK | ATTDBYRJIQZXEY-UHFFFAOYSA-N |
| TotalMolweight | 413.303 |
| Molweight | 413.303 |
| MonoisotopicMass | 412.074532 |
| CLogP | 5.8472 |
| CLogS | -6.141 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 313.85 |
| Relative PSA | 0.1466 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 2.8747 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.57143 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 8 |
| Amides | 1 |
| StereoCon |
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1 - N-benzhydryl-2-[(Z)-(3,4-dichlorophenyl)methylideneamino]oxyacetamide | 2 - N-benzhydryl-2-[(Z)-(3,4-dichlorophenyl)methylideneamino]oxyacetamide
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