2-(furan-2-ylmethylcarbamoylamino)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide
Formula:C15H16N4O4
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-(furan-2-ylmethylcarbamoylamino)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide is a drug-like molecule.
| MolName | 2-(furan-2-ylmethylcarbamoylamino)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide |
| MolecularFormula | C15H16N4O4 |
| Smiles | Oc1cccc(/C=N\NC(CNC(NCc2ccco2)=O)=O)c1 |
| InChI | InChI=1S/C15H16N4O4/c20-12-4-1-3-11(7-12)8-18-19-14(21)10-17-15(22)16-9-13-5-2-6-23-13/h1-8,20H,9-10H2,(H,19,21)(H2,16,17,22) |
| InChIK | FDRKRCQVWCNFCN-UHFFFAOYSA-N |
| TotalMolweight | 316.316 |
| Molweight | 316.316 |
| MonoisotopicMass | 316.117156 |
| CLogP | 0.8316 |
| CLogS | -3.206 |
| H Acceptors | 8 |
| H Donors | 4 |
| TotalSurfaceArea | 251.22 |
| Relative PSA | 0.39479 |
| PolarSurfaceArea | 115.96 |
| Druglikeness | 5.4768 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | acyl-hydrazone; imine/hydrazone of aldehyde |
| Shape Index | 0.69565 |
| Fragments | 1 |
| Non HAtoms | 23 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 11 |
| Sp3Atoms | 3 |
| Amides | 2 |
| StereoCon |
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1 - 2-(furan-2-ylmethylcarbamoylamino)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide | 2 - 2-(furan-2-ylmethylcarbamoylamino)-N-[(Z)-(3-hydroxyphenyl)methylideneamino]acetamide
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