2-(2-phenylphenoxy)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
Formula:C22H17N2O2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-(2-phenylphenoxy)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide is not a drug-like molecule.
| MolName | 2-(2-phenylphenoxy)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide |
| MolecularFormula | C22H17N2O2F3 |
| Smiles | O=C(COc(cccc1)c1-c1ccccc1)N/N=C\c1c(C(F)(F)F)cccc1 |
| InChI | InChI=1S/C22H17F3N2O2/c23-22(24,25)19-12-6-4-10-17(19)14-26-27-21(28)15-29-20-13-7-5-11-18(20)16-8-2-1-3-9-16/h1-14H,15H2,(H,27,28) |
| InChIK | HDLMEIMSVAIQOE-UHFFFAOYSA-N |
| TotalMolweight | 398.383 |
| Molweight | 398.383 |
| MonoisotopicMass | 398.124212 |
| CLogP | 5.284 |
| CLogS | -6.365 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 299.97 |
| Relative PSA | 0.15338 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | -2.9934 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.55172 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| StereoCon |
Click to Load Molecule:
1 - 2-(2-phenylphenoxy)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide | 2 - 2-(2-phenylphenoxy)-N-[(Z)-[2-(trifluoromethyl)phenyl]methylideneamino]acetamide
Spacefill |
Wire |
Ball & Stick |
Iso-vdw |
Opaque |
Dot Surface |
Mep |
Translucent |
Spin |
Label On |
Off