2-hydroxy-2,2-diphenyl-N-[(Z)-[3-(trifluoromethyl)phenyl]methylideneamino]acetamide
Formula:C22H17N2O2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-hydroxy-2,2-diphenyl-N-[(Z)-[3-(trifluoromethyl)phenyl]methylideneamino]acetamide is a drug-like molecule.
| MolName | 2-hydroxy-2,2-diphenyl-N-[(Z)-[3-(trifluoromethyl)phenyl]methylideneamino]acetamide |
| MolecularFormula | C22H17N2O2F3 |
| Smiles | OC(C(N/N=C\c1cccc(C(F)(F)F)c1)=O)(c1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C22H17F3N2O2/c23-22(24,25)19-13-7-8-16(14-19)15-26-27-20(28)21(29,17-9-3-1-4-10-17)18-11-5-2-6-12-18/h1-15,29H,(H,27,28) |
| InChIK | ROVAYZJTHOPPNL-UHFFFAOYSA-N |
| TotalMolweight | 398.383 |
| Molweight | 398.383 |
| MonoisotopicMass | 398.124212 |
| CLogP | 4.3302 |
| CLogS | -5.205 |
| H Acceptors | 4 |
| H Donors | 2 |
| TotalSurfaceArea | 292.97 |
| Relative PSA | 0.16763 |
| PolarSurfaceArea | 61.69 |
| Druglikeness | -1.7517 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.48276 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 3 |
| Symmetricatoms | 10 |
| StereoCon |
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1 - 2-hydroxy-2,2-diphenyl-N-[(Z)-[3-(trifluoromethyl)phenyl]methylideneamino]acetamide | 2 - 2-hydroxy-2,2-diphenyl-N-[(Z)-[3-(trifluoromethyl)phenyl]methylideneamino]acetamide
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