1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine--oxalic acid (2/1)
Chemical Structure Depiction of
1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine--oxalic acid (2/1)
1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine--oxalic acid (2/1)
Compound characteristics
| Compound ID: | 8019-7149 |
| Compound Name: | 1-({5-[(7-methoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine--oxalic acid (2/1) |
| Molecular Weight: | 377.42 |
| Molecular Formula: | C18 H24 N2 O4 |
| Salt: | 0.5HOOCCOOH |
| Smiles: | COc1cc(CC2CC(CN3CCCCC3)=NO2)cc2c1OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8806 |
| logD: | 2.6034 |
| logSw: | -2.9252 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 51.141 |
| InChI Key: | PWBNIKLMOZLDGM-HNNXBMFYSA-N |