N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-2-(2-fluorophenoxy)acetamide
Formula:C17H14N2O2ClF
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-2-(2-fluorophenoxy)acetamide is a drug-like molecule.
| MolName | N-[(Z)-[(Z)-2-chloro-3-phenylprop-2-enylidene]amino]-2-(2-fluorophenoxy)acetamide |
| MolecularFormula | C17H14N2O2ClF |
| Smiles | O=C(COc(cccc1)c1F)N/N=C\C(\Cl)=C\c1ccccc1 |
| InChI | InChI=1S/C17H14ClFN2O2/c18-14(10-13-6-2-1-3-7-13)11-20-21-17(22)12-23-16-9-5-4-8-15(16)19/h1-11H,12H2,(H,21,22) |
| InChIK | LOZHAVGRAMEENW-UHFFFAOYSA-N |
| TotalMolweight | 332.761 |
| Molweight | 332.761 |
| MonoisotopicMass | 332.072783 |
| CLogP | 3.3572 |
| CLogS | -4.798 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 257.23 |
| Relative PSA | 0.17887 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 3.1889 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.69565 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 2 |
| Symmetricatoms | 2 |
| StereoCon |
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