ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(benzenesulfonyl)methyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(benzenesulfonyl)methyl]-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(benzenesulfonyl)methyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 6703-2502 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(benzenesulfonyl)methyl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 378.36 |
| Molecular Formula: | C14 H14 N6 O5 S |
| Smiles: | CCOC(c1c(CS(c2ccccc2)(=O)=O)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.9184 |
| logD: | 0.9184 |
| logSw: | -2.1083 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 132.358 |
| InChI Key: | ISKATHYGPWIHFD-UHFFFAOYSA-N |