| MolName | (E)-N-(4-chlorophenyl)sulfanyl-2,2,2-trifluoro-1-phenylethanimine |
| MolecularFormula | C14H9NClF3S |
| Smiles | FC(/C(/c1ccccc1)=N/Sc(cc1)ccc1Cl)(F)F |
| InChI | InChI=1S/C14H9ClF3NS/c15-11-6-8-12(9-7-11)20-19-13(14(16,17)18)10-4-2-1-3-5-10/h1-9H |
| InChIK | MLKGGMYFJMQESH-UHFFFAOYSA-N |
| TotalMolweight | 315.745 |
| Molweight | 315.745 |
| MonoisotopicMass | 315.00963 |
| CLogP | 4.7647 |
| CLogS | -6.293 |
| H Acceptors | 1 |
| TotalSurfaceArea | 218.36 |
| Relative PSA | 0.13281 |
| PolarSurfaceArea | 37.66 |
| Druglikeness | -10.037 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 4 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 6 |
| BasicNitrogens | 1 |
| StereoCon |
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1 - (E)-N-(4-chlorophenyl)sulfanyl-2,2,2-trifluoro-1-phenylethanimine | 2 - (E)-N-(4-chlorophenyl)sulfanyl-2,2,2-trifluoro-1-phenylethanimine