ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
Chemical Structure Depiction of
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate
Compound characteristics
| Compound ID: | 5086-1587 |
| Compound Name: | ethyl 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-{[4-(2-hydroxyethyl)piperazin-1-yl]methyl}-1H-1,2,3-triazole-4-carboxylate |
| Molecular Weight: | 366.38 |
| Molecular Formula: | C14 H22 N8 O4 |
| Smiles: | CCOC(c1c(CN2CCN(CC2)CCO)n(c2c(N)non2)nn1)=O |
| Stereo: | ACHIRAL |
| logP: | -0.7353 |
| logD: | -1.0586 |
| logSw: | 0.3815 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 127.772 |
| InChI Key: | DBWLEDGWEYHNPE-UHFFFAOYSA-N |