1-{5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}-N-[(4-methylphenyl)methyl]methanamine
Chemical Structure Depiction of
1-{5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}-N-[(4-methylphenyl)methyl]methanamine
1-{5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}-N-[(4-methylphenyl)methyl]methanamine
Compound characteristics
| Compound ID: | 8019-4418 |
| Compound Name: | 1-{5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}-N-[(4-methylphenyl)methyl]methanamine |
| Molecular Weight: | 398.46 |
| Molecular Formula: | C22 H26 N2 O5 |
| Smiles: | Cc1ccc(CNCC2CC(Cc3cc(c4c(c3OC)OCO4)OC)ON=2)cc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.549 |
| logD: | 3.1393 |
| logSw: | -3.4613 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.575 |
| InChI Key: | FUGKVMFHVXQSHY-SFHVURJKSA-N |