1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid
Compound characteristics
| Compound ID: | 6703-1985 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[(1H-benzimidazol-2-yl)sulfanyl]methyl}-1H-1,2,3-triazole-4-carboxylic acid |
| Molecular Weight: | 358.34 |
| Molecular Formula: | C13 H10 N8 O3 S |
| Smiles: | C(c1c(C(O)=O)nnn1c1c(N)non1)Sc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 0.7204 |
| logD: | -5.2977 |
| logSw: | -1.9143 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 128.989 |
| InChI Key: | MBTGYJCGBUGJNW-UHFFFAOYSA-N |