Ajmalinium, N-methyl-, iodide
TL;DR: Ajmalinium, N-methyl-, iodide (CAS 24486-64-4) is a chemical compound with molecular formula C21H29IN2O2 and molecular weight 468.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(9R,10S,13S,14R,16S,18R)-13-ethyl-8,15-dimethyl-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol iodide
Also Known As: Jodometilato di ajmalina, Ajmalinium, N-methyl-, iodide, Jodometilato di ajmalina [Italian], KST-1A3086, (16xi,17r,21
| Molecular Formula | C21H29IN2O2 |
|---|---|
| Molecular Weight | 468.13 g/mol |
| LogP | -1.2969 |
| Topological Polar Surface Area | 43.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 468.12738 |
| Heavy Atoms | 26 |
| Complexity | 613.0 |
Chemical Identifiers
| CAS Number | 24486-64-4 |
|---|---|
| SMILES | CC[C@@H]1[C@H]([N+]2([C@H]3CC1C4[C@@H]2CC5([C@H]3N(C6=CC=CC=C65)C)[C@@H]4O)C)O.[I-] |
| InChIKey | DVXCPMVDGCXNBF-JSQWQWKUSA-M |
Product Overview
Ajmalinium, N-methyl-, iodide (CAS 24486-64-4), with molecular formula C21H29IN2O2 and molecular weight 468.13 g/mol. IUPAC: (9R,10S,13S,14R,16S,18R)-13-ethyl-8,15-dimethyl-8-aza-15-azoniahexacyclo[14.2.1.01,9.02,7.010,15.012,17]nonadeca-2,4,6-triene-14,18-diol iodide.
Chemical Property Profile of Ajmalinium, N-methyl-, iodide
Property Insights of Ajmalinium, N-methyl-, iodide
The XLogP value of -1.2969 indicates that Ajmalinium, N-methyl-, iodide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 43.7 Ų, Ajmalinium, N-methyl-, iodide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ajmalinium, N-methyl-, iodide has 2 hydrogen bond donor(s) and 4 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 Ajmalinium, N-methyl-, iodide?
The CAS number of Ajmalinium, N-methyl-, iodide is 24486-64-4.
What is the molecular formula of Ajmalinium, N-methyl-, iodide?
The molecular formula of Ajmalinium, N-methyl-, iodide is C21H29IN2O2.
What is the molecular weight of Ajmalinium, N-methyl-, iodide?
The molecular weight of Ajmalinium, N-methyl-, iodide is 468.13 g/mol.
Where can I buy Ajmalinium, N-methyl-, iodide?
You can request a quote for Ajmalinium, N-methyl-, iodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ajmalinium, N-methyl-, iodide?
Yes, KEHONG BIO provides custom synthesis services for Ajmalinium, N-methyl-, iodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.