3,3-dimethyl-2-oxobutyl 4-amino-1,2,5-oxadiazole-3-carboxylate
Chemical Structure Depiction of
3,3-dimethyl-2-oxobutyl 4-amino-1,2,5-oxadiazole-3-carboxylate
3,3-dimethyl-2-oxobutyl 4-amino-1,2,5-oxadiazole-3-carboxylate
Compound characteristics
| Compound ID: | 8014-8721 |
| Compound Name: | 3,3-dimethyl-2-oxobutyl 4-amino-1,2,5-oxadiazole-3-carboxylate |
| Molecular Weight: | 227.22 |
| Molecular Formula: | C9 H13 N3 O4 |
| Smiles: | CC(C)(C)C(COC(c1c(N)non1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2196 |
| logD: | 1.2196 |
| logSw: | -1.1489 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.7 |
| InChI Key: | GCIWICFINLMKLE-UHFFFAOYSA-N |