1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(5-chlorothiophen-2-yl)-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(5-chlorothiophen-2-yl)-1H-1,2,3-triazole-4-carboxylic acid
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(5-chlorothiophen-2-yl)-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | 8538-0112 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-(5-chlorothiophen-2-yl)-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 312.69 |
| Molecular Formula: | C9 H5 Cl N6 O3 S |
| Smiles: | c1cc(sc1c1c(C(O)=O)nnn1c1c(N)non1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 1.487 |
| logD: | -4.8521 |
| logSw: | -2.4008 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 111.513 |
| InChI Key: | MLJZFZRDKAZYSW-UHFFFAOYSA-N |