| MolName | (E)-2-(4-chlorophenyl)sulfanyl-N-[(2,4-dichlorophenyl)methoxy]-1-phenylethanimine |
| MolecularFormula | C21H16NOCl3S |
| Smiles | Clc(cc1)ccc1SC/C(/c1ccccc1)=N/OCc(ccc(Cl)c1)c1Cl |
| InChI | InChI=1S/C21H16Cl3NOS/c22-17-8-10-19(11-9-17)27-14-21(15-4-2-1-3-5-15)25-26-13-16-6-7-18(23)12-20(16)24/h1-12H,13-14H2 |
| InChIK | LWAUVHMHAHHGHE-UHFFFAOYSA-N |
| TotalMolweight | 436.789 |
| Molweight | 436.789 |
| MonoisotopicMass | 435.001815 |
| CLogP | 7.2482 |
| CLogS | -7.922 |
| H Acceptors | 2 |
| TotalSurfaceArea | 317.02 |
| Relative PSA | 0.12302 |
| PolarSurfaceArea | 46.89 |
| Druglikeness | 1.4221 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.59259 |
| Fragments | 1 |
| Non HAtoms | 27 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| StereoCon |
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1 - (E)-2-(4-chlorophenyl)sulfanyl-N-[(2,4-dichlorophenyl)methoxy]-1-phenylethanimine | 2 - (E)-2-(4-chlorophenyl)sulfanyl-N-[(2,4-dichlorophenyl)methoxy]-1-phenylethanimine