| MolName | (E)-N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-3-thiophen-2-ylprop-2-enehydrazide |
| MolecularFormula | C19H15N2O3BrS |
| Smiles | O=C(COc(ccc1ccccc11)c1Br)NNC(/C=C/c1cccs1)=O |
| InChI | InChI=1S/C19H15BrN2O3S/c20-19-15-6-2-1-4-13(15)7-9-16(19)25-12-18(24)22-21-17(23)10-8-14-5-3-11-26-14/h1-11H,12H2,(H,21,23)(H,22,24) |
| InChIK | MYZFIJAZYGLOOJ-UHFFFAOYSA-N |
| TotalMolweight | 431.309 |
| Molweight | 431.309 |
| MonoisotopicMass | 429.998674 |
| CLogP | 3.3079 |
| CLogS | -5.91 |
| H Acceptors | 5 |
| H Donors | 2 |
| TotalSurfaceArea | 290.87 |
| Relative PSA | 0.27284 |
| PolarSurfaceArea | 95.67 |
| Druglikeness | 0.66048 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.65385 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 15 |
| Sp3Atoms | 2 |
| StereoCon |
Click to Load Molecule:
1 - (E)-N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-3-thiophen-2-ylprop-2-enehydrazide | 2 - (E)-N'-[2-(1-bromonaphthalen-2-yl)oxyacetyl]-3-thiophen-2-ylprop-2-enehydrazide