BIAdb N-methylpapaverine 2788
From DrugPedia: A Wikipedia for Drug discovery
| BIAdb N-methylpapaverine 2788
| |
| Systematic (IUPAC) name | |
| 1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methylisoquinolin-2-iumiodide | |
| Identifiers | |
| CAS number | ? |
| ATC code | ? |
| PubChem | |
| Chemical data | |
| Formula | C21H24INO4 |
| Mol. mass | 481.32403 |
| SMILES | & |
| Pharmacokinetic data | |
| Bioavailability | ? |
| Metabolism | ? |
| Half life | ? |
| Excretion | ? |
| Therapeutic considerations | |
| Pregnancy cat. |
? |
| Legal status | |
| Routes | ? |
Contents |
[edit] Description
[edit] Source
N/A
[edit] Function
Relaxant
[edit] General Properties
*Molecular Weight
481.32403
*Exact Mass
481.075001
*Molecular Formula
C21H24INO4
*IUPAC NAME
1-[(3,4-dimethoxyphenyl)methyl]-6,7-dimethoxy-2-methylisoquinolin-2-iumiodide
*Canonical Smiles
C[N+]1=C(C2=CC(=C(C=C2C=C1)OC)OC)CC3=CC(=C(C=C3)OC)OC.[I-]
*Isomeric Smiles
N/A
*XLogP
N/A
*Hydrogen bond donor
0
*Hydrogen bond acceptor
5
*Rotational Bond Count
6
*Topological Polar Surface Area
40.8
