2-(4-methoxyphenyl)-1-{rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(4-methoxyphenyl)-1-{rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
2-(4-methoxyphenyl)-1-{rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | SB56-1012 |
| Compound Name: | 2-(4-methoxyphenyl)-1-{rel-(3R,4S)-3-(pyridin-3-yl)-4-[3-(pyridin-4-yl)-1,2,4-oxadiazol-5-yl]pyrrolidin-1-yl}ethan-1-one |
| Molecular Weight: | 441.49 |
| Molecular Formula: | C25 H23 N5 O3 |
| Smiles: | COc1ccc(CC(N2C[C@@H](c3nc(c4ccncc4)no3)[C@@H](C2)c2cccnc2)=O)cc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.2769 |
| logD: | 3.2752 |
| logSw: | -3.0786 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 74.216 |
| InChI Key: | OTNFZHIIFKXVMO-FCHUYYIVSA-N |