| MolName | (3Z)-3-[(2-chloro-4-fluorophenyl)methoxyimino]-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one |
| MolecularFormula | C19H14N2O2ClFS |
| Smiles | O=C(C/C=N\OCc(ccc(F)c1)c1Cl)c1cnc(-c2ccccc2)s1 |
| InChI | InChI=1S/C19H14ClFN2O2S/c20-16-10-15(21)7-6-14(16)12-25-23-9-8-17(24)18-11-22-19(26-18)13-4-2-1-3-5-13/h1-7,9-11H,8,12H2 |
| InChIK | VWIHTOXTIOGLND-UHFFFAOYSA-N |
| TotalMolweight | 388.849 |
| Molweight | 388.849 |
| MonoisotopicMass | 388.044853 |
| CLogP | 4.5331 |
| CLogS | -5.467 |
| H Acceptors | 4 |
| TotalSurfaceArea | 289.28 |
| Relative PSA | 0.22774 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | 1.6231 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.69231 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Sp3Atoms | 3 |
| Symmetricatoms | 2 |
| Aromatic Nitrogens | 1 |
| StereoCon |
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1 - (3Z)-3-[(2-chloro-4-fluorophenyl)methoxyimino]-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one | 2 - (3Z)-3-[(2-chloro-4-fluorophenyl)methoxyimino]-1-(2-phenyl-1,3-thiazol-5-yl)propan-1-one