(NZ)-N-[(4-benzylpiperazin-1-yl)-phenylmethylidene]-4-fluorobenzenesulfonamide
Formula:C24H24N3O2FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(NZ)-N-[(4-benzylpiperazin-1-yl)-phenylmethylidene]-4-fluorobenzenesulfonamide is a drug-like molecule.
| MolName | (NZ)-N-[(4-benzylpiperazin-1-yl)-phenylmethylidene]-4-fluorobenzenesulfonamide |
| MolecularFormula | C24H24N3O2FS |
| Smiles | O=S(c(cc1)ccc1F)(/N=C(/c1ccccc1)\N1CCN(Cc2ccccc2)CC1)=O |
| InChI | InChI=1S/C24H24FN3O2S/c25-22-11-13-23(14-12-22)31(29,30)26-24(21-9-5-2-6-10-21)28-17-15-27(16-18-28)19-20-7-3-1-4-8-20/h1-14H,15-19H2 |
| InChIK | HBFPSNQFFJRZHA-UHFFFAOYSA-N |
| TotalMolweight | 437.538 |
| Molweight | 437.538 |
| MonoisotopicMass | 437.157325 |
| CLogP | 4.1648 |
| CLogS | -3.557 |
| H Acceptors | 5 |
| TotalSurfaceArea | 326.58 |
| Relative PSA | 0.1445 |
| PolarSurfaceArea | 61.36 |
| Druglikeness | 6.3436 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.54839 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 7 |
| Symmetricatoms | 9 |
| Amines | 1 |
| AlkylAmines | 1 |
| BasicNitrogens | 2 |
| StereoCon |
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1 - (NZ)-N-[(4-benzylpiperazin-1-yl)-phenylmethylidene]-4-fluorobenzenesulfonamide | 2 - (NZ)-N-[(4-benzylpiperazin-1-yl)-phenylmethylidene]-4-fluorobenzenesulfonamide
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