1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(3,4,5-trimethoxyphenyl)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'-[(3,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(3,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 8007-8154 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(azepan-1-yl)methyl]-N'-[(3,4,5-trimethoxyphenyl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 499.53 |
| Molecular Formula: | C22 H29 N9 O5 |
| Smiles: | COc1cc(/C=N/NC(c2c(CN3CCCCCC3)n(c3c(N)non3)nn2)=O)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0507 |
| logD: | 1.4815 |
| logSw: | -2.6598 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 145.197 |
| InChI Key: | FBKXIZLSKRYQAO-UHFFFAOYSA-N |