| MolName | (E)-N'-[2-(2,4-dibromophenoxy)acetyl]-3-(4-fluorophenyl)prop-2-enehydrazide |
| MolecularFormula | C17H13N2O3Br2F |
| Smiles | O=C(COc(ccc(Br)c1)c1Br)NNC(/C=C/c(cc1)ccc1F)=O |
| InChI | InChI=1S/C17H13Br2FN2O3/c18-12-4-7-15(14(19)9-12)25-10-17(24)22-21-16(23)8-3-11-1-5-13(20)6-2-11/h1-9H,10H2,(H,21,23)(H,22,24) |
| InChIK | CRBOSJGTCCXNQM-UHFFFAOYSA-N |
| TotalMolweight | 472.107 |
| Molweight | 472.107 |
| MonoisotopicMass | 469.927693 |
| CLogP | 3.0729 |
| CLogS | -5.442 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 285.31 |
| Relative PSA | 0.20679 |
| PolarSurfaceArea | 67.43 |
| Druglikeness | -2.5924 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.72 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - (E)-N'-[2-(2,4-dibromophenoxy)acetyl]-3-(4-fluorophenyl)prop-2-enehydrazide | 2 - (E)-N'-[2-(2,4-dibromophenoxy)acetyl]-3-(4-fluorophenyl)prop-2-enehydrazide