2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-({3,5-diiodo-2-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)acetohydrazide
Chemical Structure Depiction of
2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-({3,5-diiodo-2-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)acetohydrazide
2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-({3,5-diiodo-2-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)acetohydrazide
Compound characteristics
| Compound ID: | 2144-0841 |
| Compound Name: | 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-({3,5-diiodo-2-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)acetohydrazide |
| Molecular Weight: | 667.2 |
| Molecular Formula: | C21 H15 I2 N7 O3 |
| Smiles: | C#CCOc1c(\C=N/NC(Cn2c3ccccc3nc2c2c(N)non2)=O)cc(cc1I)I |
| Stereo: | ACHIRAL |
| logP: | 5.2449 |
| logD: | 5.244 |
| logSw: | -5.3349 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 109.945 |
| InChI Key: | NNKSWCWAZOSJCF-UHFFFAOYSA-N |