2-[rel-(3R,4R)-1-(ethanesulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-methyl-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[rel-(3R,4R)-1-(ethanesulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-methyl-1,3,4-oxadiazole
2-[rel-(3R,4R)-1-(ethanesulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-methyl-1,3,4-oxadiazole
Compound characteristics
Compound ID: | SB54-0172 |
Compound Name: | 2-[rel-(3R,4R)-1-(ethanesulfonyl)-4-(methoxymethyl)pyrrolidin-3-yl]-5-methyl-1,3,4-oxadiazole |
Molecular Weight: | 289.35 |
Molecular Formula: | C11 H19 N3 O4 S |
Smiles: | CCS(N1C[C@@H](COC)[C@@H](C1)c1nnc(C)o1)(=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 0.035 |
logD: | 0.035 |
logSw: | -1.7494 |
Hydrogen bond acceptors count: | 9 |
Polar surface area: | 70.516 |
InChI Key: | QMVQXHORWXDXQZ-VHSXEESVSA-N |