alpha-Isosparteine methiodide
TL;DR: alpha-Isosparteine methiodide (CAS 42883-77-2) is a chemical compound with molecular formula C16H29IN2 and molecular weight 376.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2R,9R,10R)-7-methyl-15-aza-7-azoniatetracyclo[7.7.1.02,7.010,15]heptadecane iodide
Also Known As: alpha-Isosparteine methiodide, EINECS 255-987-2, 1-Methylspartein-1-ium iodide, 1-Methyl-6beta,9alpha-spartein-1-ium iodide, (7S-(7alpha,7aalpha,14alpha,14abeta))-Dodecahydro-5(or 12)-methyl-7,14-methano-2H,6H-dipyrido(1,2-a:1',2'-e)(1,5)diazocinium iodide
| Molecular Formula | C16H29IN2 |
|---|---|
| Molecular Weight | 376.14 g/mol |
| LogP | -0.5063 |
| Topological Polar Surface Area | 3.24 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 376.13754 |
| Heavy Atoms | 19 |
| Complexity | 334.71063 |
Chemical Identifiers
| CAS Number | 42883-77-2 |
|---|---|
| SMILES | C[N+]12CCCC[C@@H]1[C@H]3C[C@H](C2)[C@H]4CCCCN4C3.[I-] |
Product Overview
alpha-Isosparteine methiodide (CAS 42883-77-2), with molecular formula C16H29IN2 and molecular weight 376.14 g/mol. IUPAC: (1S,2R,9R,10R)-7-methyl-15-aza-7-azoniatetracyclo[7.7.1.02,7.010,15]heptadecane iodide.
Chemical Property Profile of alpha-Isosparteine methiodide
Property Insights of alpha-Isosparteine methiodide
The XLogP value of -0.5063 indicates that alpha-Isosparteine methiodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 3.24 Ų, alpha-Isosparteine methiodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, alpha-Isosparteine methiodide has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of alpha-Isosparteine methiodide?
The CAS number of alpha-Isosparteine methiodide is 42883-77-2.
What is the molecular formula of alpha-Isosparteine methiodide?
The molecular formula of alpha-Isosparteine methiodide is C16H29IN2.
What is the molecular weight of alpha-Isosparteine methiodide?
The molecular weight of alpha-Isosparteine methiodide is 376.14 g/mol.
Where can I buy alpha-Isosparteine methiodide?
You can request a quote for alpha-Isosparteine methiodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for alpha-Isosparteine methiodide?
Yes, KEHONG BIO provides custom synthesis services for alpha-Isosparteine methiodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.