N-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-[4-(piperidin-1-yl)phenyl]ethan-1-amine
Chemical Structure Depiction of
N-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-[4-(piperidin-1-yl)phenyl]ethan-1-amine
N-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-[4-(piperidin-1-yl)phenyl]ethan-1-amine
Compound characteristics
| Compound ID: | 8019-6194 |
| Compound Name: | N-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)-1-[4-(piperidin-1-yl)phenyl]ethan-1-amine |
| Molecular Weight: | 481.59 |
| Molecular Formula: | C27 H35 N3 O5 |
| Smiles: | CC(c1ccc(cc1)N1CCCCC1)NCC1CC(Cc2cc(c3c(c2OC)OCO3)OC)ON=1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.3277 |
| logD: | 4.1828 |
| logSw: | -4.1997 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.982 |
| InChI Key: | XBBRUIHTLGOVOW-UHFFFAOYSA-N |