2-(4-chloronaphthalen-1-yl)oxy-N-[(Z)-(2-iodophenyl)methylideneamino]acetamide
Formula:C19H14N2O2ClI
Mutagenic:none
Tumorigenic:high
Reproductive Effective:high
2-(4-chloronaphthalen-1-yl)oxy-N-[(Z)-(2-iodophenyl)methylideneamino]acetamide is not a drug-like molecule.
| MolName | 2-(4-chloronaphthalen-1-yl)oxy-N-[(Z)-(2-iodophenyl)methylideneamino]acetamide |
| MolecularFormula | C19H14N2O2ClI |
| Smiles | O=C(COc(c1ccccc11)ccc1Cl)N/N=C\c(cccc1)c1I |
| InChI | InChI=1S/C19H14ClIN2O2/c20-16-9-10-18(15-7-3-2-6-14(15)16)25-12-19(24)23-22-11-13-5-1-4-8-17(13)21/h1-11H,12H2,(H,23,24) |
| InChIK | SAUYYHDZZGVDNF-UHFFFAOYSA-N |
| TotalMolweight | 464.685 |
| Molweight | 464.685 |
| MonoisotopicMass | 463.978853 |
| CLogP | 5.014 |
| CLogS | -6.859 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 287.05 |
| Relative PSA | 0.16029 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | 4.6754 |
| Mutagenic | none |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.6 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 16 |
| Sp3Atoms | 2 |
| StereoCon |
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