1-{5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methanamine--hydrogen chloride (1/1)
Chemical Structure Depiction of
1-{5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methanamine--hydrogen chloride (1/1)
1-{5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methanamine--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 8019-4241 |
| Compound Name: | 1-{5-[(4,7-dimethoxy-2H-1,3-benzodioxol-5-yl)methyl]-4,5-dihydro-1,2-oxazol-3-yl}methanamine--hydrogen chloride (1/1) |
| Molecular Weight: | 330.77 |
| Molecular Formula: | C14 H18 N2 O5 |
| Salt: | HCl |
| Smiles: | COc1cc(CC2CC(CN)=NO2)c(c2c1OCO2)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.8288 |
| logD: | 0.3738 |
| logSw: | -1.2457 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.47 |
| InChI Key: | ZOPXUQFOIQVMSK-JTQLQIEISA-N |