4-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)morpholine--oxalic acid (2/1)
Chemical Structure Depiction of
4-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)morpholine--oxalic acid (2/1)
4-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)morpholine--oxalic acid (2/1)
Compound characteristics
| Compound ID: | 8020-0530 |
| Compound Name: | 4-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)morpholine--oxalic acid (2/1) |
| Molecular Weight: | 379.39 |
| Molecular Formula: | C17 H22 N2 O5 |
| Salt: | 0.5HOOCCOOH |
| Smiles: | COc1cc(CC2CC(CN3CCOCC3)=NO2)cc2c1OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7737 |
| logD: | 1.7722 |
| logSw: | -2.0192 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 59.049 |
| InChI Key: | ATQJHMIFVGOXHZ-AWEZNQCLSA-N |