| MolName | 4-[(2Z)-2-[[4-(difluoromethoxy)phenyl]methylidene]hydrazinyl]benzenesulfonamide |
| MolecularFormula | C14H13N3O3F2S |
| Smiles | NS(c(cc1)ccc1N/N=C\c(cc1)ccc1OC(F)F)(=O)=O |
| InChI | InChI=1S/C14H13F2N3O3S/c15-14(16)22-12-5-1-10(2-6-12)9-18-19-11-3-7-13(8-4-11)23(17,20)21/h1-9,14,19H,(H2,17,20,21) |
| InChIK | PKBOGYOCGBKKBI-UHFFFAOYSA-N |
| TotalMolweight | 341.337 |
| Molweight | 341.337 |
| MonoisotopicMass | 341.064568 |
| CLogP | 3.7743 |
| CLogS | -3.67 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 241.54 |
| Relative PSA | 0.31804 |
| PolarSurfaceArea | 102.16 |
| Druglikeness | 1.3218 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.69565 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 6 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - 4-[(2Z)-2-[[4-(difluoromethoxy)phenyl]methylidene]hydrazinyl]benzenesulfonamide | 2 - 4-[(2Z)-2-[[4-(difluoromethoxy)phenyl]methylidene]hydrazinyl]benzenesulfonamide