1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]-N'-{[4-(propan-2-yl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]-N'-{[4-(propan-2-yl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]-N'-{[4-(propan-2-yl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 6011-0811 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(4-methylpiperidin-1-yl)methyl]-N'-{[4-(propan-2-yl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 451.53 |
| Molecular Formula: | C22 H29 N9 O2 |
| Smiles: | CC1CCN(CC1)Cc1c(C(N/N=C/c2ccc(cc2)C(C)C)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | 3.4071 |
| logD: | 2.9159 |
| logSw: | -3.5239 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 121.888 |
| InChI Key: | MHFKQRJICRPRFB-UHFFFAOYSA-N |