2-(furan-2-yl)-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1,3,4-oxadiazole
Chemical Structure Depiction of
2-(furan-2-yl)-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1,3,4-oxadiazole
2-(furan-2-yl)-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | 8016-6365 |
| Compound Name: | 2-(furan-2-yl)-5-[(1-methyl-3-nitro-1H-1,2,4-triazol-5-yl)sulfanyl]-1,3,4-oxadiazole |
| Molecular Weight: | 294.24 |
| Molecular Formula: | C9 H6 N6 O4 S |
| Smiles: | Cn1c(nc(n1)[N+]([O-])=O)Sc1nnc(c2ccco2)o1 |
| Stereo: | ACHIRAL |
| logP: | 0.853 |
| logD: | 0.853 |
| logSw: | -1.7147 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 95.877 |
| InChI Key: | JTKASYHWDVCJNT-UHFFFAOYSA-N |