2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-({3-iodo-5-methoxy-4-[(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-iodo-5-methoxy-4-[(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-iodo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)acetohydrazide
Compound characteristics
| Compound ID: | 8007-5108 |
| Compound Name: | 2-[2-(4-amino-1,2,5-oxadiazol-3-yl)-1H-benzimidazol-1-yl]-N'-({3-iodo-5-methoxy-4-[(prop-2-yn-1-yl)oxy]phenyl}methylidene)acetohydrazide |
| Molecular Weight: | 571.33 |
| Molecular Formula: | C22 H18 I N7 O4 |
| Smiles: | COc1cc(\C=N/NC(Cn2c3ccccc3nc2c2c(N)non2)=O)cc(c1OCC#C)I |
| Stereo: | ACHIRAL |
| logP: | 3.8764 |
| logD: | 3.8754 |
| logSw: | -4.199 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 117.576 |
| InChI Key: | WKAHRKTTZVYYRN-UHFFFAOYSA-N |