({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-(ethoxycarbonyl)-1H-1,2,3-triazol-5-yl]methyl}sulfanyl)acetic acid
Chemical Structure Depiction of
({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-(ethoxycarbonyl)-1H-1,2,3-triazol-5-yl]methyl}sulfanyl)acetic acid
({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-(ethoxycarbonyl)-1H-1,2,3-triazol-5-yl]methyl}sulfanyl)acetic acid
Compound characteristics
| Compound ID: | 8538-0229 |
| Compound Name: | ({[1-(4-amino-1,2,5-oxadiazol-3-yl)-4-(ethoxycarbonyl)-1H-1,2,3-triazol-5-yl]methyl}sulfanyl)acetic acid |
| Molecular Weight: | 328.3 |
| Molecular Formula: | C10 H12 N6 O5 S |
| Smiles: | CCOC(c1c(CSCC(O)=O)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | 0.2342 |
| logD: | -3.2019 |
| logSw: | -0.8385 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 131.977 |
| InChI Key: | XUDZVNZXFMSWMW-UHFFFAOYSA-N |