N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2-iodobenzamide
Formula:C14H9N2OClFI
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2-iodobenzamide is a drug-like molecule.
| MolName | N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2-iodobenzamide |
| MolecularFormula | C14H9N2OClFI |
| Smiles | O=C(c(cccc1)c1I)N/N=C\c(c(F)ccc1)c1Cl |
| InChI | InChI=1S/C14H9ClFIN2O/c15-11-5-3-6-12(16)10(11)8-18-19-14(20)9-4-1-2-7-13(9)17/h1-8H,(H,19,20) |
| InChIK | VEZKVQVRISPWPK-UHFFFAOYSA-N |
| TotalMolweight | 402.589 |
| Molweight | 402.589 |
| MonoisotopicMass | 401.943216 |
| CLogP | 4.3455 |
| CLogS | -5.787 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 235.04 |
| Relative PSA | 0.15321 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 3.5674 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 20 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 3 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| StereoCon |
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1 - N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2-iodobenzamide | 2 - N-[(Z)-(2-chloro-6-fluorophenyl)methylideneamino]-2-iodobenzamide
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