N'-[(Z)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-N-phenyloxamide
Formula:C19H14N3O3Cl
Mutagenic:high
Tumorigenic:high
Reproductive Effective:none
N'-[(Z)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-N-phenyloxamide is a drug-like molecule.
| MolName | N'-[(Z)-[5-(3-chlorophenyl)furan-2-yl]methylideneamino]-N-phenyloxamide |
| MolecularFormula | C19H14N3O3Cl |
| Smiles | O=C(C(N/N=C\c1ccc(-c2cccc(Cl)c2)o1)=O)Nc1ccccc1 |
| InChI | InChI=1S/C19H14ClN3O3/c20-14-6-4-5-13(11-14)17-10-9-16(26-17)12-21-23-19(25)18(24)22-15-7-2-1-3-8-15/h1-12H,(H,22,24)(H,23,25) |
| InChIK | BEPMVIKXMNNFJB-UHFFFAOYSA-N |
| TotalMolweight | 367.791 |
| Molweight | 367.791 |
| MonoisotopicMass | 367.072369 |
| CLogP | 3.6888 |
| CLogS | -5.721 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 281.07 |
| Relative PSA | 0.26549 |
| PolarSurfaceArea | 83.7 |
| Druglikeness | 5.6688 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.65385 |
| Fragments | 1 |
| Non HAtoms | 26 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 3 |
| Small Rings | 3 |
| Aromatic Rings | 3 |
| Aromatic Atoms | 17 |
| Symmetricatoms | 2 |
| Amides | 1 |
| StereoCon |
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