N-[(Z)-(4-chlorophenyl)methylideneamino]-2,2-diphenylacetamide
Formula:C21H17N2OCl
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-(4-chlorophenyl)methylideneamino]-2,2-diphenylacetamide is not a drug-like molecule.
| MolName | N-[(Z)-(4-chlorophenyl)methylideneamino]-2,2-diphenylacetamide |
| MolecularFormula | C21H17N2OCl |
| Smiles | O=C(C(c1ccccc1)c1ccccc1)N/N=C\c(cc1)ccc1Cl |
| InChI | InChI=1S/C21H17ClN2O/c22-19-13-11-16(12-14-19)15-23-24-21(25)20(17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1-15,20H,(H,24,25) |
| InChIK | QRBMEFNMYCYYHJ-UHFFFAOYSA-N |
| TotalMolweight | 348.832 |
| Molweight | 348.832 |
| MonoisotopicMass | 348.10294 |
| CLogP | 5.3333 |
| CLogS | -5.571 |
| H Acceptors | 3 |
| H Donors | 1 |
| TotalSurfaceArea | 274.67 |
| Relative PSA | 0.1311 |
| PolarSurfaceArea | 41.46 |
| Druglikeness | 5.1905 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.56 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 4 |
| Electronegative Atoms | 4 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 18 |
| Sp3Atoms | 1 |
| Symmetricatoms | 10 |
| StereoCon |
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