1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 8009-4469 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(3-ethoxy-4-hydroxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 469.5 |
| Molecular Formula: | C21 H27 N9 O4 |
| Smiles: | CCOc1cc(/C=N/NC(c2c(CN3CCCCCC3)n(c3c(N)non3)nn2)=O)ccc1O |
| Stereo: | ACHIRAL |
| logP: | 2.0417 |
| logD: | 1.4725 |
| logSw: | -2.634 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 145.977 |
| InChI Key: | GMIXMGKUMYWTDS-UHFFFAOYSA-N |