(2H-1,3-benzodioxol-5-yl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methanone
Chemical Structure Depiction of
(2H-1,3-benzodioxol-5-yl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methanone
(2H-1,3-benzodioxol-5-yl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methanone
Compound characteristics
| Compound ID: | S826-3108 |
| Compound Name: | (2H-1,3-benzodioxol-5-yl)[rel-(3R,4R)-3-(hydroxymethyl)-4-(3-methyl-1,2,4-oxadiazol-5-yl)pyrrolidin-1-yl]methanone |
| Molecular Weight: | 331.33 |
| Molecular Formula: | C16 H17 N3 O5 |
| Smiles: | Cc1nc([C@@H]2CN(C[C@H]2CO)C(c2ccc3c(c2)OCO3)=O)on1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.7856 |
| logD: | 0.7856 |
| logSw: | -1.9386 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 82.64 |
| InChI Key: | OCEORLZPKRAFEM-NWDGAFQWSA-N |