1-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline
Chemical Structure Depiction of
1-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline
1-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline
Compound characteristics
| Compound ID: | 8012-4818 |
| Compound Name: | 1-(6-bromo-2H-1,3-benzodioxol-5-yl)-6-ethoxy-7-methoxy-1,2,3,4-tetrahydroisoquinoline |
| Molecular Weight: | 406.27 |
| Molecular Formula: | C19 H20 Br N O4 |
| Smiles: | CCOc1cc2CCNC(c2cc1OC)c1cc2c(cc1[Br])OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.6819 |
| logD: | -0.2278 |
| logSw: | -2.8284 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.114 |
| InChI Key: | KVDXCHXNUDEJGR-LJQANCHMSA-N |