5-[(6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]-1,3-dihydro-2H-benzimidazol-2-one
Chemical Structure Depiction of
5-[(6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]-1,3-dihydro-2H-benzimidazol-2-one
5-[(6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]-1,3-dihydro-2H-benzimidazol-2-one
Compound characteristics
| Compound ID: | 8008-1941 |
| Compound Name: | 5-[(6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-yl)amino]-1,3-dihydro-2H-benzimidazol-2-one |
| Molecular Weight: | 476.37 |
| Molecular Formula: | C19 H12 N10 O6 |
| Smiles: | C1Oc2cc(/C=N/Nc3c(Nc4ccc5c(c4)NC(N5)=O)nc4c(n3)non4)c(cc2O1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.5791 |
| logD: | 3.579 |
| logSw: | -3.8798 |
| Hydrogen bond acceptors count: | 14 |
| Hydrogen bond donors count: | 4 |
| Polar surface area: | 172.693 |
| InChI Key: | CZXYLLCFOWCTQE-UHFFFAOYSA-N |