N-[(Z)-[4-(cyanomethoxy)phenyl]methylideneamino]-2-hydroxy-2,2-diphenylacetamide
Formula:C23H19N3O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:high
N-[(Z)-[4-(cyanomethoxy)phenyl]methylideneamino]-2-hydroxy-2,2-diphenylacetamide is a drug-like molecule.
| MolName | N-[(Z)-[4-(cyanomethoxy)phenyl]methylideneamino]-2-hydroxy-2,2-diphenylacetamide |
| MolecularFormula | C23H19N3O3 |
| Smiles | N#CCOc1ccc(/C=N\NC(C(c2ccccc2)(c2ccccc2)O)=O)cc1 |
| InChI | InChI=1S/C23H19N3O3/c24-15-16-29-21-13-11-18(12-14-21)17-25-26-22(27)23(28,19-7-3-1-4-8-19)20-9-5-2-6-10-20/h1-14,17,28H,16H2,(H,26,27) |
| InChIK | LMEUZTUZRLDMCL-UHFFFAOYSA-N |
| TotalMolweight | 385.422 |
| Molweight | 385.422 |
| MonoisotopicMass | 385.142642 |
| CLogP | 3.0638 |
| CLogS | -4.893 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 308.98 |
| Relative PSA | 0.23519 |
| PolarSurfaceArea | 94.71 |
| Druglikeness | 0.84667 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | high |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.58621 |
| Fragments | 1 |
| Non HAtoms | 29 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 7 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 4 |
| Symmetricatoms | 10 |
| StereoCon |
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