N-[(Z)-(4-bromophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide
Formula:C15H10N2O2Br4
Mutagenic:low
Tumorigenic:none
Reproductive Effective:high
N-[(Z)-(4-bromophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide is not a drug-like molecule.
| MolName | N-[(Z)-(4-bromophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide |
| MolecularFormula | C15H10N2O2Br4 |
| Smiles | O=C(COc(c(Br)cc(Br)c1)c1Br)N/N=C\c(cc1)ccc1Br |
| InChI | InChI=1S/C15H10Br4N2O2/c16-10-3-1-9(2-4-10)7-20-21-14(22)8-23-15-12(18)5-11(17)6-13(15)19/h1-7H,8H2,(H,21,22) |
| InChIK | LFALMNQZGGNYOJ-UHFFFAOYSA-N |
| TotalMolweight | 569.872 |
| Molweight | 569.872 |
| MonoisotopicMass | 565.747572 |
| CLogP | 5.6773 |
| CLogS | -6.837 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 285.27 |
| Relative PSA | 0.16129 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 2.4066 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; polyhalo aromatic ring |
| Shape Index | 0.69565 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 5 |
| StereoCon |
Click to Load Molecule:
1 - N-[(Z)-(4-bromophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide | 2 - N-[(Z)-(4-bromophenyl)methylideneamino]-2-(2,4,6-tribromophenoxy)acetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off