2-[rel-(3R,4R)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-(methoxymethyl)pyrrolidin-3-yl]-5-phenyl-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[rel-(3R,4R)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-(methoxymethyl)pyrrolidin-3-yl]-5-phenyl-1,3,4-oxadiazole
2-[rel-(3R,4R)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-(methoxymethyl)pyrrolidin-3-yl]-5-phenyl-1,3,4-oxadiazole
Compound characteristics
Compound ID: | SB54-0783 |
Compound Name: | 2-[rel-(3R,4R)-1-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-4-(methoxymethyl)pyrrolidin-3-yl]-5-phenyl-1,3,4-oxadiazole |
Molecular Weight: | 368.43 |
Molecular Formula: | C20 H24 N4 O3 |
Smiles: | Cc1c(CN2C[C@@H](COC)[C@@H](C2)c2nnc(c3ccccc3)o2)c(C)on1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 2.4641 |
logD: | -0.7601 |
logSw: | -2.6852 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 64.91 |
InChI Key: | ZEXCXPUWDOUSLI-FUHWJXTLSA-N |