2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(4-fluorophenyl)methyl]acetamide
Formula:C17H15N2O3F3
Mutagenic:none
Tumorigenic:none
Reproductive Effective:none
2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(4-fluorophenyl)methyl]acetamide is a drug-like molecule.
| MolName | 2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(4-fluorophenyl)methyl]acetamide |
| MolecularFormula | C17H15N2O3F3 |
| Smiles | O=C(CO/N=C\c(cc1)ccc1OC(F)F)NCc(cc1)ccc1F |
| InChI | InChI=1S/C17H15F3N2O3/c18-14-5-1-12(2-6-14)9-21-16(23)11-24-22-10-13-3-7-15(8-4-13)25-17(19)20/h1-8,10,17H,9,11H2,(H,21,23) |
| InChIK | NIIPJJWFESMUBA-UHFFFAOYSA-N |
| TotalMolweight | 352.311 |
| Molweight | 352.311 |
| MonoisotopicMass | 352.103477 |
| CLogP | 3.1896 |
| CLogS | -4.345 |
| H Acceptors | 5 |
| H Donors | 1 |
| TotalSurfaceArea | 266.06 |
| Relative PSA | 0.21052 |
| PolarSurfaceArea | 59.92 |
| Druglikeness | -0.18825 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.76 |
| Fragments | 1 |
| Non HAtoms | 25 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 8 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 5 |
| Symmetricatoms | 5 |
| Amides | 1 |
| StereoCon |
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1 - 2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(4-fluorophenyl)methyl]acetamide | 2 - 2-[(Z)-[4-(difluoromethoxy)phenyl]methylideneamino]oxy-N-[(4-fluorophenyl)methyl]acetamide
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