2-(1-bromonaphthalen-2-yl)oxy-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]acetamide
Formula:C26H21N2O3Br
Mutagenic:low
Tumorigenic:low
Reproductive Effective:none
2-(1-bromonaphthalen-2-yl)oxy-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]acetamide is not a drug-like molecule.
| MolName | 2-(1-bromonaphthalen-2-yl)oxy-N-[(Z)-(4-phenylmethoxyphenyl)methylideneamino]acetamide |
| MolecularFormula | C26H21N2O3Br |
| Smiles | O=C(COc(ccc1ccccc11)c1Br)N/N=C\c(cc1)ccc1OCc1ccccc1 |
| InChI | InChI=1S/C26H21BrN2O3/c27-26-23-9-5-4-8-21(23)12-15-24(26)32-18-25(30)29-28-16-19-10-13-22(14-11-19)31-17-20-6-2-1-3-7-20/h1-16H,17-18H2,(H,29,30) |
| InChIK | QBJADUVSMUISSS-UHFFFAOYSA-N |
| TotalMolweight | 489.368 |
| Molweight | 489.368 |
| MonoisotopicMass | 488.073554 |
| CLogP | 6.0442 |
| CLogS | -7.282 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 347.5 |
| Relative PSA | 0.16118 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | 2.4066 |
| Mutagenic | low |
| Tumorigenic | low |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.6875 |
| Fragments | 1 |
| Non HAtoms | 32 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 8 |
| Rings Closures | 4 |
| Small Rings | 4 |
| Aromatic Rings | 4 |
| Aromatic Atoms | 22 |
| Sp3Atoms | 4 |
| Symmetricatoms | 4 |
| StereoCon |
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