2-(1-acetylpiperidin-4-yl)-1-{4-[rel-(2R,3R)-3-methoxy-2-(pyridin-4-yl)azetidin-1-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
2-(1-acetylpiperidin-4-yl)-1-{4-[rel-(2R,3R)-3-methoxy-2-(pyridin-4-yl)azetidin-1-yl]piperidin-1-yl}ethan-1-one
2-(1-acetylpiperidin-4-yl)-1-{4-[rel-(2R,3R)-3-methoxy-2-(pyridin-4-yl)azetidin-1-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
Compound ID: | S742-0116 |
Compound Name: | 2-(1-acetylpiperidin-4-yl)-1-{4-[rel-(2R,3R)-3-methoxy-2-(pyridin-4-yl)azetidin-1-yl]piperidin-1-yl}ethan-1-one |
Molecular Weight: | 414.55 |
Molecular Formula: | C23 H34 N4 O3 |
Smiles: | CC(N1CCC(CC1)CC(N1CCC(CC1)N1C[C@@H]([C@@H]1c1ccncc1)OC)=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.2964 |
logD: | 1.0612 |
logSw: | -1.224 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 52.78 |
InChI Key: | WGMCPVYAGXLSHP-JTHBVZDNSA-N |