1-{4-[rel-(3R,4S)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-4-(pyridin-3-yl)pyrrolidin-1-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[rel-(3R,4S)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-4-(pyridin-3-yl)pyrrolidin-1-yl]piperidin-1-yl}ethan-1-one
1-{4-[rel-(3R,4S)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-4-(pyridin-3-yl)pyrrolidin-1-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | SB56-0624 |
| Compound Name: | 1-{4-[rel-(3R,4S)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)-4-(pyridin-3-yl)pyrrolidin-1-yl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 417.51 |
| Molecular Formula: | C24 H27 N5 O2 |
| Smiles: | CC(N1CCC(CC1)N1C[C@@H](c2nc(c3ccccc3)no2)[C@@H](C1)c1cccnc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 3.3759 |
| logD: | 0.351 |
| logSw: | -3.2358 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.604 |
| InChI Key: | MSXMKTHFLBUXHY-FCHUYYIVSA-N |