2-{rel-(3R,4R)-4-(methoxymethyl)-1-[(5-methylthiophen-2-yl)methyl]pyrrolidin-3-yl}-5-phenyl-1,3,4-oxadiazole
Chemical Structure Depiction of
2-{rel-(3R,4R)-4-(methoxymethyl)-1-[(5-methylthiophen-2-yl)methyl]pyrrolidin-3-yl}-5-phenyl-1,3,4-oxadiazole
2-{rel-(3R,4R)-4-(methoxymethyl)-1-[(5-methylthiophen-2-yl)methyl]pyrrolidin-3-yl}-5-phenyl-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | SB54-1015 |
| Compound Name: | 2-{rel-(3R,4R)-4-(methoxymethyl)-1-[(5-methylthiophen-2-yl)methyl]pyrrolidin-3-yl}-5-phenyl-1,3,4-oxadiazole |
| Molecular Weight: | 369.48 |
| Molecular Formula: | C20 H23 N3 O2 S |
| Smiles: | Cc1ccc(CN2C[C@@H](COC)[C@@H](C2)c2nnc(c3ccccc3)o2)s1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.7302 |
| logD: | 1.2392 |
| logSw: | -4.0593 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.89 |
| InChI Key: | BFAUDVMSSZBECX-FUHWJXTLSA-N |