N-[(Z)-benzylideneamino]-2-(3-bromophenoxy)acetamide
Formula:C15H13N2O2Br
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-benzylideneamino]-2-(3-bromophenoxy)acetamide is a drug-like molecule.
| MolName | N-[(Z)-benzylideneamino]-2-(3-bromophenoxy)acetamide |
| MolecularFormula | C15H13N2O2Br |
| Smiles | O=C(COc1cccc(Br)c1)N/N=C\c1ccccc1 |
| InChI | InChI=1S/C15H13BrN2O2/c16-13-7-4-8-14(9-13)20-11-15(19)18-17-10-12-5-2-1-3-6-12/h1-10H,11H2,(H,18,19) |
| InChIK | IWILZMPIGXJLBP-UHFFFAOYSA-N |
| TotalMolweight | 333.184 |
| Molweight | 333.184 |
| MonoisotopicMass | 332.016039 |
| CLogP | 3.5017 |
| CLogS | -4.335 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 229.38 |
| Relative PSA | 0.20058 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 2.4066 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.7 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 5 |
| Electronegative Atoms | 5 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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