N-benzhydryl-2-[(Z)-(4-bromophenyl)methylideneamino]oxyacetamide
Formula:C22H19N2O2Br
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-benzhydryl-2-[(Z)-(4-bromophenyl)methylideneamino]oxyacetamide is not a drug-like molecule.
| MolName | N-benzhydryl-2-[(Z)-(4-bromophenyl)methylideneamino]oxyacetamide |
| MolecularFormula | C22H19N2O2Br |
| Smiles | O=C(CO/N=C\c(cc1)ccc1Br)NC(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C22H19BrN2O2/c23-20-13-11-17(12-14-20)15-24-27-16-21(26)25-22(18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15,22H,16H2,(H,25,26) |
| InChIK | PSZWRTWQLBYAKX-UHFFFAOYSA-N |
| TotalMolweight | 423.309 |
| Molweight | 423.309 |
| MonoisotopicMass | 422.062989 |
| CLogP | 5.3604 |
| CLogS | -5.503 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 301.64 |
| Relative PSA | 0.15253 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 1.0305 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59259 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 10 |
| Amides | 1 |
| StereoCon |
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1 - N-benzhydryl-2-[(Z)-(4-bromophenyl)methylideneamino]oxyacetamide | 2 - N-benzhydryl-2-[(Z)-(4-bromophenyl)methylideneamino]oxyacetamide
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