2-{[5-(4-acetamido-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(1H-tetrazol-1-yl)phenyl]acetamide
Chemical Structure Depiction of
2-{[5-(4-acetamido-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(1H-tetrazol-1-yl)phenyl]acetamide
2-{[5-(4-acetamido-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(1H-tetrazol-1-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | D291-0123 |
| Compound Name: | 2-{[5-(4-acetamido-1,2,5-oxadiazol-3-yl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-[4-(1H-tetrazol-1-yl)phenyl]acetamide |
| Molecular Weight: | 455.46 |
| Molecular Formula: | C17 H17 N11 O3 S |
| Smiles: | CCn1c(c2c(NC(C)=O)non2)nnc1SCC(Nc1ccc(cc1)n1cnnn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.295 |
| logD: | 1.2903 |
| logSw: | -2.3031 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 147.17 |
| InChI Key: | FXTXHFUZWZFEPM-UHFFFAOYSA-N |