1-{4-[rel-(3R,4R)-1-(oxan-4-yl)-4-(phenoxymethyl)pyrrolidin-3-yl]piperidin-1-yl}ethan-1-one
Chemical Structure Depiction of
1-{4-[rel-(3R,4R)-1-(oxan-4-yl)-4-(phenoxymethyl)pyrrolidin-3-yl]piperidin-1-yl}ethan-1-one
1-{4-[rel-(3R,4R)-1-(oxan-4-yl)-4-(phenoxymethyl)pyrrolidin-3-yl]piperidin-1-yl}ethan-1-one
Compound characteristics
| Compound ID: | S995-0692 |
| Compound Name: | 1-{4-[rel-(3R,4R)-1-(oxan-4-yl)-4-(phenoxymethyl)pyrrolidin-3-yl]piperidin-1-yl}ethan-1-one |
| Molecular Weight: | 386.53 |
| Molecular Formula: | C23 H34 N2 O3 |
| Smiles: | CC(N1CCC(CC1)[C@@H]1CN(C[C@H]1COc1ccccc1)C1CCOCC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.9193 |
| logD: | 0.6632 |
| logSw: | -2.9396 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.009 |
| InChI Key: | NYVYTDGWEWPYOU-NFBKMPQASA-N |