2-{5-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-3-nitro-1H-1,2,4-triazol-1-yl}acetamide
Chemical Structure Depiction of
2-{5-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-3-nitro-1H-1,2,4-triazol-1-yl}acetamide
2-{5-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-3-nitro-1H-1,2,4-triazol-1-yl}acetamide
Compound characteristics
| Compound ID: | 8017-1067 |
| Compound Name: | 2-{5-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-3-nitro-1H-1,2,4-triazol-1-yl}acetamide |
| Molecular Weight: | 285.24 |
| Molecular Formula: | C6 H7 N9 O3 S |
| Smiles: | Cn1c(nnn1)Sc1nc(nn1CC(N)=O)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | -1.3654 |
| logD: | -1.3654 |
| logSw: | -0.6722 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 130.646 |
| InChI Key: | LVKLARHWZHVVEL-UHFFFAOYSA-N |