1-(2H-1,3-benzodioxol-5-yl)-N-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)methanamine
Chemical Structure Depiction of
1-(2H-1,3-benzodioxol-5-yl)-N-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)methanamine
1-(2H-1,3-benzodioxol-5-yl)-N-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)methanamine
Compound characteristics
| Compound ID: | 8019-7201 |
| Compound Name: | 1-(2H-1,3-benzodioxol-5-yl)-N-({5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methyl)methanamine |
| Molecular Weight: | 464.9 |
| Molecular Formula: | C22 H24 N2 O7 |
| Salt: | HCl |
| Smiles: | COc1cc(CC2CC(CNCc3ccc4c(c3)OCO4)=NO2)c(c2c1OCO2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0388 |
| logD: | 2.1395 |
| logSw: | -3.2155 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.691 |
| InChI Key: | ZAFCEKSELPGFSL-INIZCTEOSA-N |