| MolName | 2-(2,4-dibromo-6-methylphenoxy)-N'-(4-methylphenyl)sulfonylacetohydrazide |
| MolecularFormula | C16H16N2O4Br2S |
| Smiles | Cc(cc1)ccc1S(NNC(COc(c(C)cc(Br)c1)c1Br)=O)(=O)=O |
| InChI | InChI=1S/C16H16Br2N2O4S/c1-10-3-5-13(6-4-10)25(22,23)20-19-15(21)9-24-16-11(2)7-12(17)8-14(16)18/h3-8,20H,9H2,1-2H3,(H,19,21) |
| InChIK | FZOFPRCUKMDSER-UHFFFAOYSA-N |
| TotalMolweight | 492.187 |
| Molweight | 492.187 |
| MonoisotopicMass | 489.91975 |
| CLogP | 2.4062 |
| CLogS | -3.641 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 287.81 |
| Relative PSA | 0.25899 |
| PolarSurfaceArea | 92.88 |
| Druglikeness | -5.1712 |
| Mutagenic | low |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.64 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 3 |
| StereoCon |
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1 - 2-(2,4-dibromo-6-methylphenoxy)-N'-(4-methylphenyl)sulfonylacetohydrazide | 2 - 2-(2,4-dibromo-6-methylphenoxy)-N'-(4-methylphenyl)sulfonylacetohydrazide