3-methyl-1-{4-[rel-(2R,3R)-3-phenoxy-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}butan-1-one
Chemical Structure Depiction of
3-methyl-1-{4-[rel-(2R,3R)-3-phenoxy-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}butan-1-one
3-methyl-1-{4-[rel-(2R,3R)-3-phenoxy-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}butan-1-one
Compound characteristics
| Compound ID: | S759-0304 |
| Compound Name: | 3-methyl-1-{4-[rel-(2R,3R)-3-phenoxy-1-(propan-2-yl)azetidin-2-yl]piperidin-1-yl}butan-1-one |
| Molecular Weight: | 358.52 |
| Molecular Formula: | C22 H34 N2 O2 |
| Smiles: | CC(C)CC(N1CCC(CC1)[C@H]1[C@H](CN1C(C)C)Oc1ccccc1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 4.359 |
| logD: | 0.2163 |
| logSw: | -4.1269 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 26.4022 |
| InChI Key: | CTQHZIYTMRLIKZ-RBBKRZOGSA-N |