N-(2H-1,3-benzodioxol-5-yl)-5-(1-methyl-4-nitro-1H-imidazol-5-yl)-1,3,4-oxadiazol-2-amine
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-5-(1-methyl-4-nitro-1H-imidazol-5-yl)-1,3,4-oxadiazol-2-amine
N-(2H-1,3-benzodioxol-5-yl)-5-(1-methyl-4-nitro-1H-imidazol-5-yl)-1,3,4-oxadiazol-2-amine
Compound characteristics
| Compound ID: | 8018-2829 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-5-(1-methyl-4-nitro-1H-imidazol-5-yl)-1,3,4-oxadiazol-2-amine |
| Molecular Weight: | 330.26 |
| Molecular Formula: | C13 H10 N6 O5 |
| Smiles: | Cn1cnc(c1c1nnc(Nc2ccc3c(c2)OCO3)o1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.959 |
| logD: | 0.959 |
| logSw: | -2.015 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.961 |
| InChI Key: | JPHXYUITPBXBFX-UHFFFAOYSA-N |