4-[5-[(Z)-(benzylhydrazinylidene)methyl]furan-2-yl]benzenesulfonamide
Formula:C18H17N3O3S
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
4-[5-[(Z)-(benzylhydrazinylidene)methyl]furan-2-yl]benzenesulfonamide is a drug-like molecule.
| MolName | 4-[5-[(Z)-(benzylhydrazinylidene)methyl]furan-2-yl]benzenesulfonamide |
| MolecularFormula | C18H17N3O3S |
| Smiles | NS(c(cc1)ccc1-c1ccc(/C=N\NCc2ccccc2)o1)(=O)=O |
| InChI | InChI=1S/C18H17N3O3S/c19-25(22,23)17-9-6-15(7-10-17)18-11-8-16(24-18)13-21-20-12-14-4-2-1-3-5-14/h1-11,13,20H,12H2,(H2,19,22,23) |
| InChIK | GHOFPAZRKSGDJB-UHFFFAOYSA-N |
| TotalMolweight | 355.417 |
| Molweight | 355.417 |
| MonoisotopicMass | 355.099062 |
| CLogP | 2.8221 |
| CLogS | -4.951 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 269.55 |
| Relative PSA | 0.30024 |
| PolarSurfaceArea | 106.07 |
| Druglikeness | 6.3626 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.68 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 3 |
| Symmetricatoms | 5 |
| Amides | 1 |
| StereoCon |
Click to Load Molecule:
1 - 4-[5-[(Z)-(benzylhydrazinylidene)methyl]furan-2-yl]benzenesulfonamide | 2 - 4-[5-[(Z)-(benzylhydrazinylidene)methyl]furan-2-yl]benzenesulfonamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off