(2E)-1,2-diphenyl-2-[(Z)-[2-(trifluoromethyl)phenyl]methylidenehydrazinylidene]ethanone
Formula:C22H15N2OF3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
(2E)-1,2-diphenyl-2-[(Z)-[2-(trifluoromethyl)phenyl]methylidenehydrazinylidene]ethanone is not a drug-like molecule.
| MolName | (2E)-1,2-diphenyl-2-[(Z)-[2-(trifluoromethyl)phenyl]methylidenehydrazinylidene]ethanone |
| MolecularFormula | C22H15N2OF3 |
| Smiles | O=C(/C(/c1ccccc1)=N/N=C\c1c(C(F)(F)F)cccc1)c1ccccc1 |
| InChI | InChI=1S/C22H15F3N2O/c23-22(24,25)19-14-8-7-13-18(19)15-26-27-20(16-9-3-1-4-10-16)21(28)17-11-5-2-6-12-17/h1-15H |
| InChIK | TXADWIHHWXBCJN-UHFFFAOYSA-N |
| TotalMolweight | 380.368 |
| Molweight | 380.368 |
| MonoisotopicMass | 380.113647 |
| CLogP | 6.1254 |
| CLogS | -6.586 |
| H Acceptors | 3 |
| TotalSurfaceArea | 287.72 |
| Relative PSA | 0.12533 |
| PolarSurfaceArea | 41.79 |
| Druglikeness | -4.3928 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | dimethylene-hydrazine; imine/hydrazone of aldehyde |
| Shape Index | 0.46429 |
| Fragments | 1 |
| Non HAtoms | 28 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 6 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 6 |
| StereoCon |
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