N-(4-iodophenyl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
Chemical Structure Depiction of
N-(4-iodophenyl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
N-(4-iodophenyl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine
Compound characteristics
| Compound ID: | 8008-5398 |
| Compound Name: | N-(4-iodophenyl)-6-{2-[(6-nitro-2H-1,3-benzodioxol-5-yl)methylidene]hydrazinyl}[1,2,5]oxadiazolo[3,4-b]pyrazin-5-amine |
| Molecular Weight: | 546.24 |
| Molecular Formula: | C18 H11 I N8 O5 |
| Smiles: | C1Oc2cc(/C=N/Nc3c(Nc4ccc(cc4)I)nc4c(n3)non4)c(cc2O1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 5.6317 |
| logD: | 5.6315 |
| logSw: | -5.9119 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 136.967 |
| InChI Key: | ORCHMJLESGFYHP-UHFFFAOYSA-N |