N-[(2H-1,3-benzodioxol-4-yl)methyl]-2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethan-1-amine--oxalic acid (1/1)
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-4-yl)methyl]-2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethan-1-amine--oxalic acid (1/1)
N-[(2H-1,3-benzodioxol-4-yl)methyl]-2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethan-1-amine--oxalic acid (1/1)
Compound characteristics
| Compound ID: | 8018-1268 |
| Compound Name: | N-[(2H-1,3-benzodioxol-4-yl)methyl]-2-[2,2-dimethyl-4-(propan-2-yl)oxan-4-yl]ethan-1-amine--oxalic acid (1/1) |
| Molecular Weight: | 423.5 |
| Molecular Formula: | C20 H31 N O3 |
| Salt: | HOOCCOOH |
| Smiles: | CC(C)C1(CCNCc2cccc3c2OCO3)CCOC(C)(C)C1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.8337 |
| logD: | 1.3456 |
| logSw: | -3.9842 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 36.036 |
| InChI Key: | VUVAWWRENAFGRX-FQEVSTJZSA-N |