7-bromoethoxyphenyl tetrahydropalatine
From DrugPedia: A Wikipedia for Drug discovery
| 7-bromoethoxyphenyl tetrahydropalatine
| |
| Systematic (IUPAC) name | |
| 7-[2-(2-bromoethoxy)phenyl]-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C29H33BrNO5+ |
| Mol. mass | 555.48002 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
[edit] Description
RN given from Toxlit 11/89
[edit] General Properties
*Molecular Weight
555.48002
*Molecular Formula
C29H33BrNO5+
*IUPAC NAME
7-[2-(2-bromoethoxy)phenyl]-2,3,9,10-tetramethoxy-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium
*Canonical Smiles
COC1=C(C2=C(CC3C4=CC(=C(C=C4CC[N+]3(C2)C5=CC=CC=C5OCCBr)OC)OC)C=C1)OC
*Isomeric Smiles
N/A
*XLogP
N/A
*Topological Polar Surface Area
46.2
