1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(3,4-dihydroquinolin-1(2H)-yl)methyl]-N'-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(3,4-dihydroquinolin-1(2H)-yl)methyl]-N'-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(3,4-dihydroquinolin-1(2H)-yl)methyl]-N'-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 8010-3677 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(3,4-dihydroquinolin-1(2H)-yl)methyl]-N'-[(1,5-dimethyl-1H-pyrazol-4-yl)methylidene]-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 461.48 |
| Molecular Formula: | C21 H23 N11 O2 |
| Smiles: | Cc1c(\C=N/NC(c2c(CN3CCCc4ccccc34)n(c3c(N)non3)nn2)=O)cnn1C |
| Stereo: | ACHIRAL |
| logP: | 1.7551 |
| logD: | 1.7294 |
| logSw: | -2.2866 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 135.204 |
| InChI Key: | KFXHGOSGSDUUFC-UHFFFAOYSA-N |