N-[(Z)-(3-phenoxyphenyl)methylideneamino]-2-[3-(trifluoromethyl)phenyl]acetamide
Formula:C22H17N2O2F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(3-phenoxyphenyl)methylideneamino]-2-[3-(trifluoromethyl)phenyl]acetamide is not a drug-like molecule.
| MolName | N-[(Z)-(3-phenoxyphenyl)methylideneamino]-2-[3-(trifluoromethyl)phenyl]acetamide |
| MolecularFormula | C22H17N2O2F3 |
| Smiles | O=C(Cc1cccc(C(F)(F)F)c1)N/N=C\c1cc(Oc2ccccc2)ccc1 |
| InChI | InChI=1S/C22H17F3N2O2/c23-22(24,25)18-8-4-6-16(12-18)14-21(28)27-26-15-17-7-5-11-20(13-17)29-19-9-2-1-3-10-19/h1-13,15H,14H2,(H,27,28) |
| InChIK | UHTINSAIBMKROH-UHFFFAOYSA-N |
| TotalMolweight | 398.383 |
| Molweight | 398.383 |
| MonoisotopicMass | 398.124212 |
| CLogP | 5.4436 |
| CLogS | -6.761 |
| H Acceptors | 4 |
| H Donors | 1 |
| TotalSurfaceArea | 299.97 |
| Relative PSA | 0.15338 |
| PolarSurfaceArea | 50.69 |
| Druglikeness | -2.9268 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.62069 |
| 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 |
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