4-amino-N'-({3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene)-1,2,5-oxadiazole-3-carbohydrazide
Chemical Structure Depiction of
4-amino-N'-({3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene)-1,2,5-oxadiazole-3-carbohydrazide
4-amino-N'-({3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene)-1,2,5-oxadiazole-3-carbohydrazide
Compound characteristics
| Compound ID: | 5408-2837 |
| Compound Name: | 4-amino-N'-({3-[(1,3,7-trimethyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)oxy]phenyl}methylidene)-1,2,5-oxadiazole-3-carbohydrazide |
| Molecular Weight: | 439.39 |
| Molecular Formula: | C18 H17 N9 O5 |
| Smiles: | [H]N(C(c1c(N)non1)=O)/N=C/c1cccc(c1)Oc1nc2c(C(N(C)C(N2C)=O)=O)n1C |
| Stereo: | ACHIRAL |
| logP: | 1.524 |
| logD: | 1.5234 |
| logSw: | -2.2959 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 143.235 |
| InChI Key: | JFSJXLIHBWBKAT-UHFFFAOYSA-N |