1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(carboxymethyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(carboxymethyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(carboxymethyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | 8538-0152 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(carboxymethyl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 300.25 |
| Molecular Formula: | C8 H8 N6 O5 S |
| Smiles: | C(C(O)=O)SCc1c(C(O)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | -0.8504 |
| logD: | -6.9678 |
| logSw: | -0.4462 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 139.631 |
| InChI Key: | BZWJXEJFUSIWKR-UHFFFAOYSA-N |