1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-{[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-{[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-{[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 6011-0600 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(dimethylamino)methyl]-N'-{[4-(methylsulfanyl)phenyl]methylidene}-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 401.45 |
| Molecular Formula: | C16 H19 N9 O2 S |
| Smiles: | CN(C)Cc1c(C(N/N=C/c2ccc(cc2)SC)=O)nnn1c1c(N)non1 |
| Stereo: | ACHIRAL |
| logP: | 1.3589 |
| logD: | 0.8984 |
| logSw: | -2.4228 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 122.042 |
| InChI Key: | AXODKSXPQQOLNP-UHFFFAOYSA-N |