1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{[5-iodo-2-(methylsulfanyl)thiophen-3-yl]methylidene}-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Chemical Structure Depiction of
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{[5-iodo-2-(methylsulfanyl)thiophen-3-yl]methylidene}-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{[5-iodo-2-(methylsulfanyl)thiophen-3-yl]methylidene}-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide
Compound characteristics
| Compound ID: | 2130-0034 |
| Compound Name: | 1-(4-amino-1,2,5-oxadiazol-3-yl)-N'-{[5-iodo-2-(methylsulfanyl)thiophen-3-yl]methylidene}-5-phenyl-1H-1,2,3-triazole-4-carbohydrazide |
| Molecular Weight: | 552.37 |
| Molecular Formula: | C17 H13 I N8 O2 S2 |
| Smiles: | CSc1c(/C=N/NC(c2c(c3ccccc3)n(c3c(N)non3)nn2)=O)cc(s1)I |
| Stereo: | ACHIRAL |
| logP: | 4.3114 |
| logD: | 4.3113 |
| logSw: | -4.4966 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 118.421 |
| InChI Key: | HXDXPQIMPHAEKG-UHFFFAOYSA-N |