N-[(Z)-furan-2-ylmethylideneamino]-2-(3-oxo-4H-quinoxalin-2-yl)acetamide
Formula:C15H12N4O3
Mutagenic:high
Tumorigenic:none
Reproductive Effective:none
N-[(Z)-furan-2-ylmethylideneamino]-2-(3-oxo-4H-quinoxalin-2-yl)acetamide is a drug-like molecule.
| MolName | N-[(Z)-furan-2-ylmethylideneamino]-2-(3-oxo-4H-quinoxalin-2-yl)acetamide |
| MolecularFormula | C15H12N4O3 |
| Smiles | O=C(CC1=Nc(cccc2)c2NC1=O)N/N=C\c1ccco1 |
| InChI | InChI=1S/C15H12N4O3/c20-14(19-16-9-10-4-3-7-22-10)8-13-15(21)18-12-6-2-1-5-11(12)17-13/h1-7,9H,8H2,(H,18,21)(H,19,20) |
| InChIK | JARZBHHEWUUGSB-UHFFFAOYSA-N |
| TotalMolweight | 296.285 |
| Molweight | 296.285 |
| MonoisotopicMass | 296.090941 |
| CLogP | 0.8856 |
| CLogS | -3.531 |
| H Acceptors | 7 |
| H Donors | 2 |
| TotalSurfaceArea | 229.12 |
| Relative PSA | 0.37592 |
| PolarSurfaceArea | 96.06 |
| Druglikeness | 6.5354 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.63636 |
| Fragments | 1 |
| Non HAtoms | 22 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 4 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Amides | 1 |
| StereoCon |
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