N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta)
TL;DR: N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta) (CAS 120021-25-2) is a chemical compound with molecular formula C22H28INO5 and molecular weight 513.1012 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(13S,13aR)-2,3,10,11-tetramethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-13-ol iodide
Also Known As: N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta), 6H-Dibenzo(a,g)quinolizinium, 5,8,13,13a-tetrahydro-13-hydroxy-7-methyl-2,3,10,11-tetramethoxy-, iodide, (7-alpha,13-alpha,13a-beta)-(+-)-, (13S,13aR)-2,3,10,11-tetramethoxy-7-methyl-6,8,13,13a-tetrahydro-5H-isoquinolino[2,1-b]isoquinolin-7-ium-13-ol iodide
Technical Specifications
| Molecular Formula | C22H28INO5 |
| Molecular Weight | 513.1012 g/mol |
| XLogP | 0.016 |
| Topological Polar Surface Area (TPSA) | 57.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 513.1012 Da |
| Heavy Atoms | 29 |
| Complexity | 547.0 |
| SMILES | C[N+]12CCC3=CC(=C(C=C3[C@@H]1[C@H](C4=CC(=C(C=C4C2)OC)OC)O)OC)OC.[I-] |
| InChIKey | ANXDBALJIGZCGD-UYLWVFEMSA-M |
Chemical Property Profile of N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta)
Property Insights of N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta)
The XLogP value of 0.016 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta). With a topological polar surface area (TPSA) of 57.2 Ų, N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta) has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta)?
The CAS number of N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta) is 120021-25-2.
What is the molecular formula of N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta)?
The molecular formula of N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta) is C22H28INO5.
What is the molecular weight of N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta)?
The molecular weight of N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta) is 513.1012 g/mol.
Where can I buy N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta)?
You can request a quote for N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta)?
Yes, CoreyChem provides custom synthesis services for N-Methyl (+-)-13-alpha-hydroxyxylopinine iodide (beta) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.