2-[4-[(Z)-(benzenesulfonylhydrazinylidene)methyl]phenoxy]-N-(2-phenylethyl)acetamide
Formula:C23H23N3O4S
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[4-[(Z)-(benzenesulfonylhydrazinylidene)methyl]phenoxy]-N-(2-phenylethyl)acetamide is a drug-like molecule.
| MolName | 2-[4-[(Z)-(benzenesulfonylhydrazinylidene)methyl]phenoxy]-N-(2-phenylethyl)acetamide |
| MolecularFormula | C23H23N3O4S |
| Smiles | O=C(COc1ccc(/C=N\NS(c2ccccc2)(=O)=O)cc1)NCCc1ccccc1 |
| InChI | InChI=1S/C23H23N3O4S/c27-23(24-16-15-19-7-3-1-4-8-19)18-30-21-13-11-20(12-14-21)17-25-26-31(28,29)22-9-5-2-6-10-22/h1-14,17,26H,15-16,18H2,(H,24,27) |
| InChIK | XKPQITZXDDWCKW-UHFFFAOYSA-N |
| TotalMolweight | 437.519 |
| Molweight | 437.519 |
| MonoisotopicMass | 437.140927 |
| CLogP | 3.139 |
| CLogS | -3.136 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 338.07 |
| Relative PSA | 0.25453 |
| PolarSurfaceArea | 105.24 |
| Druglikeness | -1.6879 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | imine/hydrazone of aldehyde |
| Shape Index | 0.70968 |
| Fragments | 1 |
| Non HAtoms | 31 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 9 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 5 |
| Symmetricatoms | 7 |
| Amides | 1 |
| StereoCon |
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1 - 2-[4-[(Z)-(benzenesulfonylhydrazinylidene)methyl]phenoxy]-N-(2-phenylethyl)acetamide | 2 - 2-[4-[(Z)-(benzenesulfonylhydrazinylidene)methyl]phenoxy]-N-(2-phenylethyl)acetamide
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