2-phenyl-N-[(Z)-[4-(trifluoromethoxy)phenyl]methylideneamino]acetamide
Formula:C16H13N2O2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-phenyl-N-[(Z)-[4-(trifluoromethoxy)phenyl]methylideneamino]acetamide is a drug-like molecule.
| MolName | 2-phenyl-N-[(Z)-[4-(trifluoromethoxy)phenyl]methylideneamino]acetamide |
| MolecularFormula | C16H13N2O2F3 |
| Smiles | O=C(Cc1ccccc1)N/N=C\c(cc1)ccc1OC(F)(F)F |
| InChI | InChI=1S/C16H13F3N2O2/c17-16(18,19)23-14-8-6-13(7-9-14)11-20-21-15(22)10-12-4-2-1-3-5-12/h1-9,11H,10H2,(H,21,22) |
| InChIK | CUMUUNZCUWKTEI-UHFFFAOYSA-N |
| TotalMolweight | 322.285 |
| Molweight | 322.285 |
| MonoisotopicMass | 322.092912 |
| CLogP | 4.2987 |
| CLogS | -4.709 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 240.21 |
| Relative PSA | 0.19154 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | -3.7368 |
| 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 | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 6 |
| StereoCon |
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1 - 2-phenyl-N-[(Z)-[4-(trifluoromethoxy)phenyl]methylideneamino]acetamide | 2 - 2-phenyl-N-[(Z)-[4-(trifluoromethoxy)phenyl]methylideneamino]acetamide
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