(2E)-2-(benzenesulfonyl)-2-[(4-chlorophenyl)hydrazinylidene]-1-phenylethanone
Formula:C20H15N2O3ClS
Mutagenic:none
Tumorigenic:none
Reproductive Effective:low
(2E)-2-(benzenesulfonyl)-2-[(4-chlorophenyl)hydrazinylidene]-1-phenylethanone is a drug-like molecule.
| MolName | (2E)-2-(benzenesulfonyl)-2-[(4-chlorophenyl)hydrazinylidene]-1-phenylethanone |
| MolecularFormula | C20H15N2O3ClS |
| Smiles | O=C(/C(/S(c1ccccc1)(=O)=O)=N\Nc(cc1)ccc1Cl)c1ccccc1 |
| InChI | InChI=1S/C20H15ClN2O3S/c21-16-11-13-17(14-12-16)22-23-20(19(24)15-7-3-1-4-8-15)27(25,26)18-9-5-2-6-10-18/h1-14,22H |
| InChIK | SCSWKOOPJHDAPP-UHFFFAOYSA-N |
| TotalMolweight | 398.869 |
| Molweight | 398.869 |
| MonoisotopicMass | 398.04919 |
| CLogP | 4.4425 |
| CLogS | -4.676 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 288.96 |
| Relative PSA | 0.22353 |
| PolarSurfaceArea | 83.98 |
| Druglikeness | -5.0999 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | low |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.48148 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 7 |
| StereoCon |
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