N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide
Formula:C15H9N2O2Br3Cl2
Mutagenic:low
Tumorigenic:none
Reproductive Effective:high
N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide is not a drug-like molecule.
| MolName | N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide |
| MolecularFormula | C15H9N2O2Br3Cl2 |
| Smiles | O=C(COc(c(Br)cc(Br)c1)c1Br)N/N=C\c(cccc1Cl)c1Cl |
| InChI | InChI=1S/C15H9Br3Cl2N2O2/c16-9-4-10(17)15(11(18)5-9)24-7-13(23)22-21-6-8-2-1-3-12(19)14(8)20/h1-6H,7H2,(H,22,23) |
| InChIK | MUOMTNJXHYPPBU-UHFFFAOYSA-N |
| TotalMolweight | 559.866 |
| Molweight | 559.866 |
| MonoisotopicMass | 555.759115 |
| CLogP | 6.1641 |
| CLogS | -7.475 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 297.48 |
| Relative PSA | 0.15467 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 2.4378 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; polyhalo aromatic ring |
| Shape Index | 0.625 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 3 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide | 2 - N-[(Z)-(2,3-dichlorophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off