| MolName | (Z)-3-(3,4-dichlorophenyl)-N-(2,3,4,5,6-pentafluorophenyl)prop-2-enamide |
| MolecularFormula | C15H6NOCl2F5 |
| Smiles | O=C(/C=C\c(cc1)cc(Cl)c1Cl)Nc(c(F)c(c(F)c1F)F)c1F |
| InChI | InChI=1S/C15H6Cl2F5NO/c16-7-3-1-6(5-8(7)17)2-4-9(24)23-15-13(21)11(19)10(18)12(20)14(15)22/h1-5H,(H,23,24) |
| InChIK | FPUOLHVGNVOHHI-UHFFFAOYSA-N |
| TotalMolweight | 382.115 |
| Molweight | 382.115 |
| MonoisotopicMass | 380.974658 |
| CLogP | 4.8523 |
| CLogS | -6.54 |
| H Acceptors | 2 |
| H Donors | 1 |
| TotalSurfaceArea | 251.32 |
| Relative PSA | 0.097485 |
| PolarSurfaceArea | 29.1 |
| Druglikeness | -1.7029 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | high |
| Nasty Functions | polyhalo aromatic ring |
| Shape Index | 0.58333 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 9 |
| Electronegative Atoms | 9 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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1 - (Z)-3-(3,4-dichlorophenyl)-N-(2,3,4,5,6-pentafluorophenyl)prop-2-enamide | 2 - (Z)-3-(3,4-dichlorophenyl)-N-(2,3,4,5,6-pentafluorophenyl)prop-2-enamide