1-({5-[(4,7-dimethoxy-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-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine--oxalic acid (2/1)
1-({5-[(4,7-dimethoxy-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: | 8019-4362 |
| Compound Name: | 1-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)piperidine--oxalic acid (2/1) |
| Molecular Weight: | 407.44 |
| Molecular Formula: | C19 H26 N2 O5 |
| Salt: | 0.5HOOCCOOH |
| Smiles: | COc1cc(CC2CC(CN3CCCCC3)=NO2)c(c2c1OCO2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8242 |
| logD: | 2.547 |
| logSw: | -2.8934 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 58.542 |
| InChI Key: | NKNORRXTTGWRSN-HNNXBMFYSA-N |