1-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine
Chemical Structure Depiction of
1-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine
1-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine
Compound characteristics
| Compound ID: | 8009-7898 |
| Compound Name: | 1-[5-(4-chloro-3-nitrophenyl)furan-2-yl]-N-(4H-1,2,4-triazol-4-yl)methanimine |
| Molecular Weight: | 317.69 |
| Molecular Formula: | C13 H8 Cl N5 O3 |
| Smiles: | C(\c1ccc(c2ccc(c(c2)[N+]([O-])=O)[Cl])o1)=N/n1cnnc1 |
| Stereo: | ACHIRAL |
| logP: | 2.1492 |
| logD: | 2.1484 |
| logSw: | -3.0745 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.856 |
| InChI Key: | FDJGDOYWMYXNRB-UHFFFAOYSA-N |