5-(2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetamido)-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Chemical Structure Depiction of
5-(2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetamido)-2-phenyl-2H-1,2,3-triazole-4-carboxamide
5-(2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetamido)-2-phenyl-2H-1,2,3-triazole-4-carboxamide
Compound characteristics
| Compound ID: | 8013-3059 |
| Compound Name: | 5-(2-{5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetamido)-2-phenyl-2H-1,2,3-triazole-4-carboxamide |
| Molecular Weight: | 435.47 |
| Molecular Formula: | C19 H17 N9 O2 S |
| Smiles: | CSc1ccc(cc1)c1nnn(CC(Nc2c(C(N)=O)nn(c3ccccc3)n2)=O)n1 |
| Stereo: | ACHIRAL |
| logP: | 1.9038 |
| logD: | 1.902 |
| logSw: | -2.6373 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 121.293 |
| InChI Key: | ZEQMRUBRXVNVJN-UHFFFAOYSA-N |