3-(2-{4-[rel-(2R,3R)-3-methoxy-2-(pyridin-3-yl)azetidin-1-yl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Chemical Structure Depiction of
3-(2-{4-[rel-(2R,3R)-3-methoxy-2-(pyridin-3-yl)azetidin-1-yl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
3-(2-{4-[rel-(2R,3R)-3-methoxy-2-(pyridin-3-yl)azetidin-1-yl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one
Compound characteristics
| Compound ID: | S757-0088 |
| Compound Name: | 3-(2-{4-[rel-(2R,3R)-3-methoxy-2-(pyridin-3-yl)azetidin-1-yl]piperidin-1-yl}-2-oxoethyl)-1,3-benzoxazol-2(3H)-one |
| Molecular Weight: | 422.48 |
| Molecular Formula: | C23 H26 N4 O4 |
| Smiles: | CO[C@H]1CN(C2CCN(CC2)C(CN2C(=O)Oc3ccccc23)=O)[C@H]1c1cccnc1 |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.4617 |
| logD: | 0.9041 |
| logSw: | -1.1825 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.582 |
| InChI Key: | PBDFLWNRHMVBMX-RBBKRZOGSA-N |