rel-(1R,4R)-4-(hydroxymethyl)-6-(4-methyl-1,2,5-oxadiazole-3-carbonyl)-3-oxabicyclo[3.1.0]hexan-2-one
Chemical Structure Depiction of
rel-(1R,4R)-4-(hydroxymethyl)-6-(4-methyl-1,2,5-oxadiazole-3-carbonyl)-3-oxabicyclo[3.1.0]hexan-2-one
rel-(1R,4R)-4-(hydroxymethyl)-6-(4-methyl-1,2,5-oxadiazole-3-carbonyl)-3-oxabicyclo[3.1.0]hexan-2-one
Compound characteristics
| Compound ID: | 8019-8005 |
| Compound Name: | rel-(1R,4R)-4-(hydroxymethyl)-6-(4-methyl-1,2,5-oxadiazole-3-carbonyl)-3-oxabicyclo[3.1.0]hexan-2-one |
| Molecular Weight: | 238.2 |
| Molecular Formula: | C10 H10 N2 O5 |
| Smiles: | Cc1c(C(C2[C@H]3C(=O)O[C@H](CO)[C@@H]23)=O)non1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.5269 |
| logD: | 0.5263 |
| logSw: | -0.5042 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 90.357 |
| InChI Key: | HNBPMXNVVURBDQ-RARXMTEBSA-N |