2-[rel-(3R,4R)-1-(2,5-dimethoxybenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-methyl-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[rel-(3R,4R)-1-(2,5-dimethoxybenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-methyl-1,3,4-oxadiazole
2-[rel-(3R,4R)-1-(2,5-dimethoxybenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-methyl-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | SB54-0176 |
| Compound Name: | 2-[rel-(3R,4R)-1-(2,5-dimethoxybenzene-1-sulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-methyl-1,3,4-oxadiazole |
| Molecular Weight: | 397.45 |
| Molecular Formula: | C17 H23 N3 O6 S |
| Smiles: | Cc1nnc([C@@H]2CN(C[C@H]2COC)S(c2cc(ccc2OC)OC)(=O)=O)o1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.203 |
| logD: | 1.203 |
| logSw: | -2.5169 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 85.524 |
| InChI Key: | GBTQBKWSODZPDL-GXTWGEPZSA-N |