2-[N-(benzenesulfonyl)anilino]-N-[(Z)-(4-fluorophenyl)methylideneamino]acetamide
Formula:C21H18N3O3FS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[N-(benzenesulfonyl)anilino]-N-[(Z)-(4-fluorophenyl)methylideneamino]acetamide is a drug-like molecule.
| MolName | 2-[N-(benzenesulfonyl)anilino]-N-[(Z)-(4-fluorophenyl)methylideneamino]acetamide |
| MolecularFormula | C21H18N3O3FS |
| Smiles | O=C(CN(c1ccccc1)S(c1ccccc1)(=O)=O)N/N=C\c(cc1)ccc1F |
| InChI | InChI=1S/C21H18FN3O3S/c22-18-13-11-17(12-14-18)15-23-24-21(26)16-25(19-7-3-1-4-8-19)29(27,28)20-9-5-2-6-10-20/h1-15H,16H2,(H,24,26) |
| InChIK | SFJAAJMDQVORNC-UHFFFAOYSA-N |
| TotalMolweight | 411.456 |
| Molweight | 411.456 |
| MonoisotopicMass | 411.10529 |
| CLogP | 3.1516 |
| CLogS | -5.24 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 305.74 |
| Relative PSA | 0.22287 |
| PolarSurfaceArea | 87.22 |
| Druglikeness | -1.482 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.55172 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 2 |
| Symmetricatoms | 7 |
| Amides | 1 |
| StereoCon |
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1 - 2-[N-(benzenesulfonyl)anilino]-N-[(Z)-(4-fluorophenyl)methylideneamino]acetamide | 2 - 2-[N-(benzenesulfonyl)anilino]-N-[(Z)-(4-fluorophenyl)methylideneamino]acetamide
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