rel-(4aR,9aS)-6-hydroxy-9a-(piperidin-1-yl)-3,4,4a,9a-tetrahydro[1]benzofuro[2,3-c]pyridin-1(2H)-one
Chemical Structure Depiction of
rel-(4aR,9aS)-6-hydroxy-9a-(piperidin-1-yl)-3,4,4a,9a-tetrahydro[1]benzofuro[2,3-c]pyridin-1(2H)-one
rel-(4aR,9aS)-6-hydroxy-9a-(piperidin-1-yl)-3,4,4a,9a-tetrahydro[1]benzofuro[2,3-c]pyridin-1(2H)-one
Compound characteristics
| Compound ID: | 8018-3321 |
| Compound Name: | rel-(4aR,9aS)-6-hydroxy-9a-(piperidin-1-yl)-3,4,4a,9a-tetrahydro[1]benzofuro[2,3-c]pyridin-1(2H)-one |
| Molecular Weight: | 288.34 |
| Molecular Formula: | C16 H20 N2 O3 |
| Smiles: | [H][C@]12CCNC([C@]2(N2CCCCC2)Oc2ccc(cc12)O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9241 |
| logD: | 1.9239 |
| logSw: | -2.5232 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 52.972 |
| InChI Key: | QKYAVBGXIOSTHN-BBRMVZONSA-N |