N'-[(Z)-(2-fluorophenyl)methylideneamino]-N-(furan-2-ylmethyl)oxamide
Formula:C14H12N3O3F
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
N'-[(Z)-(2-fluorophenyl)methylideneamino]-N-(furan-2-ylmethyl)oxamide is a drug-like molecule.
| MolName | N'-[(Z)-(2-fluorophenyl)methylideneamino]-N-(furan-2-ylmethyl)oxamide |
| MolecularFormula | C14H12N3O3F |
| Smiles | O=C(C(N/N=C\c(cccc1)c1F)=O)NCc1ccco1 |
| InChI | InChI=1S/C14H12FN3O3/c15-12-6-2-1-4-10(12)8-17-18-14(20)13(19)16-9-11-5-3-7-21-11/h1-8H,9H2,(H,16,19)(H,18,20) |
| InChIK | PUONFUKPIHASME-UHFFFAOYSA-N |
| TotalMolweight | 289.265 |
| Molweight | 289.265 |
| MonoisotopicMass | 289.08627 |
| CLogP | 1.1428 |
| CLogS | -3.337 |
| H Acceptors | 6 |
| H Donors | 2 |
| TotalSurfaceArea | 226 |
| Relative PSA | 0.33018 |
| PolarSurfaceArea | 83.7 |
| Druglikeness | 2.5288 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde; limit! oxal-diamide |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 21 |
| NonCHAtoms | 7 |
| Electronegative Atoms | 7 |
| Rotatable Bond | 5 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 1 |
| Amides | 1 |
| StereoCon |
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1 - N'-[(Z)-(2-fluorophenyl)methylideneamino]-N-(furan-2-ylmethyl)oxamide | 2 - N'-[(Z)-(2-fluorophenyl)methylideneamino]-N-(furan-2-ylmethyl)oxamide
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