1-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine
Chemical Structure Depiction of
1-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine
1-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine
Compound characteristics
| Compound ID: | 2083-0538 |
| Compound Name: | 1-[5-(2-methoxy-4-nitrophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine |
| Molecular Weight: | 313.27 |
| Molecular Formula: | C14 H11 N5 O4 |
| Smiles: | COc1cc(ccc1c1ccc(\C=N/n2cnnc2)o1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 1.9909 |
| logD: | 1.99 |
| logSw: | -2.5791 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 82.788 |
| InChI Key: | PIAAMHIRKCRJEO-UHFFFAOYSA-N |