3-methyl-1-{rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
Chemical Structure Depiction of
3-methyl-1-{rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
3-methyl-1-{rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | SB56-0702 |
| Compound Name: | 3-methyl-1-{rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}butan-1-one |
| Molecular Weight: | 377.44 |
| Molecular Formula: | C21 H23 N5 O2 |
| Smiles: | CC(C)CC(N1C[C@@H](c2nc(c3ccncc3)no2)[C@@H](C1)c1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9763 |
| logD: | 2.9746 |
| logSw: | -2.8965 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 66.944 |
| InChI Key: | RGWNRQAXHKXXIB-ZWKOTPCHSA-N |