N-[(Z)-(2,3,4,5,6-pentafluorophenyl)methylideneamino]benzamide
Formula:C14H7N2OF5
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2,3,4,5,6-pentafluorophenyl)methylideneamino]benzamide is a drug-like molecule.
| MolName | N-[(Z)-(2,3,4,5,6-pentafluorophenyl)methylideneamino]benzamide |
| MolecularFormula | C14H7N2OF5 |
| Smiles | O=C(c1ccccc1)N/N=C\c(c(F)c(c(F)c1F)F)c1F |
| InChI | InChI=1S/C14H7F5N2O/c15-9-8(10(16)12(18)13(19)11(9)17)6-20-21-14(22)7-4-2-1-3-5-7/h1-6H,(H,21,22) |
| InChIK | KEFMYDOEKLBQMV-UHFFFAOYSA-N |
| TotalMolweight | 314.213 |
| Molweight | 314.213 |
| MonoisotopicMass | 314.047853 |
| CLogP | 3.7056 |
| CLogS | -5.291 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 218.74 |
| Relative PSA | 0.16462 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 3.1287 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; polyhalo aromatic ring |
| Shape Index | 0.59091 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Symmetricatoms | 6 |
| StereoCon |
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1 - N-[(Z)-(2,3,4,5,6-pentafluorophenyl)methylideneamino]benzamide | 2 - N-[(Z)-(2,3,4,5,6-pentafluorophenyl)methylideneamino]benzamide
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