3-{rel-(3R,4S)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-yl}pyridine
Chemical Structure Depiction of
3-{rel-(3R,4S)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-yl}pyridine
3-{rel-(3R,4S)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-yl}pyridine
Compound characteristics
Compound ID: | SB56-1052 |
Compound Name: | 3-{rel-(3R,4S)-1-[(1-ethyl-5-methyl-1H-pyrazol-4-yl)methyl]-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-yl}pyridine |
Molecular Weight: | 415.5 |
Molecular Formula: | C23 H25 N7 O |
Smiles: | CCn1c(C)c(CN2C[C@@H](c3nc(c4ccncc4)no3)[C@@H](C2)c2cccnc2)cn1 |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 2.4622 |
logD: | -3.0766 |
logSw: | -2.4132 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 68.209 |
InChI Key: | WKXSHRZMFDCZJJ-RTWAWAEBSA-N |