1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-2-phenoxyethan-1-one
Chemical Structure Depiction of
1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-2-phenoxyethan-1-one
1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-2-phenoxyethan-1-one
Compound characteristics
| Compound ID: | S826-3232 |
| Compound Name: | 1-[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]-2-phenoxyethan-1-one |
| Molecular Weight: | 317.34 |
| Molecular Formula: | C16 H19 N3 O4 |
| Smiles: | Cc1nc([C@@H]2CN(C[C@H]2CO)C(COc2ccccc2)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.746 |
| logD: | 0.746 |
| logSw: | -1.6895 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.497 |
| InChI Key: | JAQQXBQGRATGMR-GXTWGEPZSA-N |