| MolName | 2-[2-chloro-4-[(Z)-2-nitroethenyl]phenoxy]-N-(2-fluorophenyl)acetamide |
| MolecularFormula | C16H12N2O4ClF |
| Smiles | [O-][N+](/C=C\c(cc1)cc(Cl)c1OCC(Nc(cccc1)c1F)=O)=O |
| InChI | InChI=1S/C16H12ClFN2O4/c17-12-9-11(7-8-20(22)23)5-6-15(12)24-10-16(21)19-14-4-2-1-3-13(14)18/h1-9H,10H2,(H,19,21) |
| InChIK | VEODKYINWYEFJJ-UHFFFAOYSA-N |
| TotalMolweight | 350.732 |
| Molweight | 350.732 |
| MonoisotopicMass | 350.046963 |
| CLogP | 2.199 |
| CLogS | -4.968 |
| H Acceptors | 6 |
| H Donors | 1 |
| TotalSurfaceArea | 257.93 |
| Relative PSA | 0.2517 |
| PolarSurfaceArea | 84.15 |
| Druglikeness | -5.4877 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Nasty Functions | |
| Shape Index | 0.66667 |
| Fragments | 1 |
| Non HAtoms | 24 |
| NonCHAtoms | 8 |
| Electronegative Atoms | 8 |
| Rotatable Bond | 6 |
| Rings Closures | 2 |
| Small Rings | 2 |
| Aromatic Rings | 2 |
| Aromatic Atoms | 12 |
| Sp3Atoms | 3 |
| Amides | 1 |
| AcidicOxygens | 1 |
| StereoCon |
Click to Load Molecule:
1 - 2-[2-chloro-4-[(Z)-2-nitroethenyl]phenoxy]-N-(2-fluorophenyl)acetamide | 2 - 2-[2-chloro-4-[(Z)-2-nitroethenyl]phenoxy]-N-(2-fluorophenyl)acetamide