N-[(Z)-benzylideneamino]-2-[(2-phenoxyacetyl)amino]acetamide
Formula:C17H17N3O3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-benzylideneamino]-2-[(2-phenoxyacetyl)amino]acetamide is a drug-like molecule.
| MolName | N-[(Z)-benzylideneamino]-2-[(2-phenoxyacetyl)amino]acetamide |
| MolecularFormula | C17H17N3O3 |
| Smiles | O=C(CNC(COc1ccccc1)=O)N/N=C\c1ccccc1 |
| InChI | InChI=1S/C17H17N3O3/c21-16(20-19-11-14-7-3-1-4-8-14)12-18-17(22)13-23-15-9-5-2-6-10-15/h1-11H,12-13H2,(H,18,22)(H,20,21) |
| InChIK | CCXFSXLVJZMUKL-UHFFFAOYSA-N |
| TotalMolweight | 311.34 |
| Molweight | 311.34 |
| MonoisotopicMass | 311.126992 |
| CLogP | 1.8602 |
| CLogS | -3.268 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 253.72 |
| Relative PSA | 0.2779 |
| PolarSurfaceArea | 79.79 |
| Druglikeness | 5.1895 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.73913 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 6 |
| Electronegative Atoms | 6 |
| Rotatable Bond | 7 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Symmetricatoms | 4 |
| Amides | 1 |
| StereoCon |
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