| MolName | 2-(2-bromophenoxy)-N-[(Z)-[2-[(3-bromophenyl)methoxy]naphthalen-1-yl]methylideneamino]acetamide |
| MolecularFormula | C26H20N2O3Br2 |
| Smiles | O=C(COc(cccc1)c1Br)N/N=C\c(c1ccccc1cc1)c1OCc1cc(Br)ccc1 |
| InChI | InChI=1S/C26H20Br2N2O3/c27-20-8-5-6-18(14-20)16-32-24-13-12-19-7-1-2-9-21(19)22(24)15-29-30-26(31)17-33-25-11-4-3-10-23(25)28/h1-15H,16-17H2,(H,30,31) |
| InChIK | KXULDUVWWSGKNF-UHFFFAOYSA-N |
| TotalMolweight | 568.264 |
| Molweight | 568.264 |
| MonoisotopicMass | 565.984065 |
| CLogP | 6.7694 |
| CLogS | -8.116 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 366.13 |
| Relative PSA | 0.15298 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | 2.4066 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.54545 |
| Fragments | 1 |
| Non HAtoms | 33 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 8 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 4 |
| StereoCon |
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1 - 2-(2-bromophenoxy)-N-[(Z)-[2-[(3-bromophenyl)methoxy]naphthalen-1-yl]methylideneamino]acetamide | 2 - 2-(2-bromophenoxy)-N-[(Z)-[2-[(3-bromophenyl)methoxy]naphthalen-1-yl]methylideneamino]acetamide