2-[rel-(3R,4R)-4-(methoxymethyl)-1-{[4-(propan-2-yl)phenyl]methyl}pyrrolidin-3-yl]-5-(propan-2-yl)-1,3,4-oxadiazole
Chemical Structure Depiction of
2-[rel-(3R,4R)-4-(methoxymethyl)-1-{[4-(propan-2-yl)phenyl]methyl}pyrrolidin-3-yl]-5-(propan-2-yl)-1,3,4-oxadiazole
2-[rel-(3R,4R)-4-(methoxymethyl)-1-{[4-(propan-2-yl)phenyl]methyl}pyrrolidin-3-yl]-5-(propan-2-yl)-1,3,4-oxadiazole
Compound characteristics
| Compound ID: | SB54-0331 |
| Compound Name: | 2-[rel-(3R,4R)-4-(methoxymethyl)-1-{[4-(propan-2-yl)phenyl]methyl}pyrrolidin-3-yl]-5-(propan-2-yl)-1,3,4-oxadiazole |
| Molecular Weight: | 357.5 |
| Molecular Formula: | C21 H31 N3 O2 |
| Smiles: | CC(C)c1ccc(CN2C[C@@H](COC)[C@@H](C2)c2nnc(C(C)C)o2)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.1548 |
| logD: | 1.3992 |
| logSw: | -4.2208 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 43.143 |
| InChI Key: | OOOJVYNAUBEZIN-MOPGFXCFSA-N |