ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorobenzene-1-sulfonyl)methyl]-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorobenzene-1-sulfonyl)methyl]-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorobenzene-1-sulfonyl)methyl]-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 8017-1143 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-chlorobenzene-1-sulfonyl)methyl]-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 412.81 |
| Molecular Formula: | C14 H13 Cl N6 O5 S |
| Smiles: | CCOC(c1c(CS(c2ccc(cc2)[Cl])(=O)=O)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.6981 |
| logD: | 1.6981 |
| logSw: | -2.678 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 132.358 |
| InChI Key: | WMOOOVYOGQGBAX-UHFFFAOYSA-N |