rel-(3R,4R)-1-(2H-1,3-benzodioxole-5-carbonyl)-4-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-methylpyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-(2H-1,3-benzodioxole-5-carbonyl)-4-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-methylpyrrolidine-3-carboxamide
rel-(3R,4R)-1-(2H-1,3-benzodioxole-5-carbonyl)-4-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-methylpyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S640-3257 |
| Compound Name: | rel-(3R,4R)-1-(2H-1,3-benzodioxole-5-carbonyl)-4-[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]-N-methylpyrrolidine-3-carboxamide |
| Molecular Weight: | 388.38 |
| Molecular Formula: | C18 H20 N4 O6 |
| Smiles: | CNC([C@@H]1CN(C[C@H]1c1nc(COC)no1)C(c1ccc2c(c1)OCO2)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.1679 |
| logD: | 0.1679 |
| logSw: | -1.9075 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 100.162 |
| InChI Key: | CCSOBXHSRPFKFR-VXGBXAGGSA-N |