rel-(1R,3R)-5,8-dibromo-1,3-di(prop-2-en-1-yl)-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)
Chemical Structure Depiction of
rel-(1R,3R)-5,8-dibromo-1,3-di(prop-2-en-1-yl)-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)
rel-(1R,3R)-5,8-dibromo-1,3-di(prop-2-en-1-yl)-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | 5310-1026 |
| Compound Name: | rel-(1R,3R)-5,8-dibromo-1,3-di(prop-2-en-1-yl)-1,2,3,4-tetrahydroisoquinoline--hydrogen chloride (1/1) |
| Molecular Weight: | 407.57 |
| Molecular Formula: | C15 H17 Br2 N |
| Salt: | HCl |
| Smiles: | C=CC[C@@H]1Cc2c(ccc(c2[C@@H](CC=C)N1)[Br])[Br] |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 5.2895 |
| logD: | 5.1709 |
| logSw: | -5.8208 |
| Hydrogen bond acceptors count: | 1 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 13.072 |
| InChI Key: | PWYXIEYQBHGUIV-HZMBPMFUSA-N |