[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]{rel-(3R,4R)-3-(methoxymethyl)-4-[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]pyrrolidin-1-yl}methanone
Chemical Structure Depiction of
[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]{rel-(3R,4R)-3-(methoxymethyl)-4-[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]pyrrolidin-1-yl}methanone
[5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]{rel-(3R,4R)-3-(methoxymethyl)-4-[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]pyrrolidin-1-yl}methanone
Compound characteristics
| Compound ID: | SB54-0336 |
| Compound Name: | [5-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)-1,2-oxazol-3-yl]{rel-(3R,4R)-3-(methoxymethyl)-4-[5-(propan-2-yl)-1,3,4-oxadiazol-2-yl]pyrrolidin-1-yl}methanone |
| Molecular Weight: | 442.52 |
| Molecular Formula: | C22 H30 N6 O4 |
| Smiles: | CCn1c(C)c(c(C)n1)c1cc(C(N2C[C@@H](COC)[C@@H](C2)c2nnc(C(C)C)o2)=O)no1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.94 |
| logD: | 1.94 |
| logSw: | -2.4285 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 91.872 |
| InChI Key: | WKCPDEUERLDSAM-JKSUJKDBSA-N |