| MolName | 4-bromo-N'-[(1E)-cycloocten-1-yl]benzohydrazide |
| MolecularFormula | C15H19N2OBr |
| Smiles | O=C(c(cc1)ccc1Br)NN/C1=C/CCCCCC1 |
| InChI | InChI=1S/C15H19BrN2O/c16-13-10-8-12(9-11-13)15(19)18-17-14-6-4-2-1-3-5-7-14/h6,8-11,17H,1-5,7H2,(H,18,19) |
| InChIK | NIHLRASTUCTZJI-UHFFFAOYSA-N |
| TotalMolweight | 323.233 |
| Molweight | 323.233 |
| MonoisotopicMass | 322.068074 |
| CLogP | 4.4144 |
| CLogS | -4.908 |
| H Acceptors | 3 |
| H Donors | 2 |
| TotalSurfaceArea | 226.33 |
| Relative PSA | 0.15888 |
| PolarSurfaceArea | 41.13 |
| Druglikeness | -5.6624 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.68421 |
| Fragments | 1 |
| Non HAtoms | 19 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3Atoms | 7 |
| Symmetricatoms | 2 |
| StereoCon |
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1 - 4-bromo-N'-[(1E)-cycloocten-1-yl]benzohydrazide | 2 - 4-bromo-N'-[(1E)-cycloocten-1-yl]benzohydrazide